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PDB entries

H4B : Summary

Code

H4B

One-letter code

Molecule name

5,6,7,8-TETRAHYDROBIOPTERIN

Systematic names

Program	Version	Name
ACDLabs	10.04	(6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydropteridin-4(3H)-one
OpenEye OEToolkits	1.5.0	(6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydro-3H-pteridin-4-one

Formula

C9 H15 N5 O3

Formal charge

Molecular weight

241.247 Da

SMILES

Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C1C=2NC(CNC=2N=C(N1)N)C(O)C(O)C
SMILES	CACTVS	3.341	C[CH](O)[CH](O)[CH]1CNC2=C(N1)C(=O)NC(=N2)N
SMILES	OpenEye OEToolkits	1.5.0	CC(C(C1CNC2=C(N1)C(=O)NC(=N2)N)O)O
Canonical SMILES	CACTVS	3.341	C[C@H](O)[C@H](O)[C@H]1CNC2=C(N1)C(=O)NC(=N2)N
Canonical SMILES	OpenEye OEToolkits	1.5.0	C[C@@H]([C@@H]([C@H]1CNC2=C(N1)C(=O)NC(=N2)N)O)O

IUPAC InChI

InChI=1S/C9H15N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3-4,6,12,15-16H,2H2,1H3,(H4,10,11,13,14,17)/t3-,4+,6-/m0/s1

IUPAC InChI key

FNKQXYHWGSIFBK-RPDRRWSUSA-N

wwPDB Information
Atom count	32 (17 without Hydrogen)
Polymer type	Bound ligand
Type description	NON-POLYMER
Type code	HETAIN
Is modified	No
Standard parent	Not Assigned
Defined at	1999-07-08
Last modified at	2011-06-04
Status	Released
Obsoleted	Not Assigned

H4B : Atoms of Molecule

Total Number of Atoms: 32

Record	Atom Name	Symbol	PDB Name	Stereochemistry	Is Aromatic	Is Leaving Atom	X-Coordinate	Y-Coordinate	Z-Coordinate
1	N1	N	N1	N	Y	N	-1.207	0.564	-2.216
2	C2	C	C2	N	Y	N	-0.213	0.636	-3.075
3	N2	N	N2	N	N	N	-0.406	1.285	-4.269
4	N3	N	N3	N	Y	N	1.0	0.082	-2.809
5	C4	C	C4	N	Y	N	1.211	-0.562	-1.641
6	O4	O	O4	N	N	N	2.297	-1.064	-1.392
7	C4A	C	C4A	N	Y	N	0.158	-0.642	-0.723
8	N8	N	N8	N	N	N	-2.112	-0.125	-0.142
9	C8A	C	C8A	N	Y	N	-1.059	-0.059	-1.041
10	N5	N	N5	N	N	N	0.326	-1.306	0.512
11	C6	C	C6	R	N	N	-0.662	-1.066	1.575
12	C7	C	C7	N	N	N	-2.061	-1.113	0.944
13	C9	C	C9	R	N	N	-0.423	0.308	2.202
14	O9	O	O9	N	N	N	-1.396	0.542	3.223
15	C10	C	C10	S	N	N	0.978	0.353	2.814
16	C11	C	C11	N	N	N	1.217	1.728	3.441
17	O10	O	O10	N	N	N	1.951	0.119	1.793
18	HN21	H	1HN2	N	N	N	-1.267	1.683	-4.471
19	HN22	H	2HN2	N	N	N	0.318	1.345	-4.911
20	HN3	H	HN3	N	N	N	1.717	0.151	-3.46
21	HN5	H	HN5	N	N	N	1.074	-1.907	0.655
22	HN8	H	HN8	N	N	N	-2.872	0.471	-0.229
23	H6	H	H6	N	N	N	-0.576	-1.839	2.339
24	H71	H	1H7	N	N	N	-2.251	-2.109	0.545
25	H72	H	2H7	N	N	N	-2.811	-0.87	1.697
26	H9	H	H9	N	N	N	-0.509	1.077	1.435
27	HO9	H	HO9	N	N	N	-1.285	-0.158	3.88
28	H10	H	H10	N	N	N	1.065	-0.415	3.581
29	H111	H	1H11	N	N	N	2.216	1.76	3.876
30	H112	H	2H11	N	N	N	1.13	2.497	2.673
31	H113	H	3H11	N	N	N	0.475	1.906	4.219
32	HO0	H	HO0	N	N	N	1.84	0.82	1.136

H4B : Chemical Bonds

Total Number of Bonds: 33

Record	First Atom	Second Atom	First Element	Second Element	Bond Order Type	Bond Length	Bond Stereochemistry	Is Aromatic
1	N1	C2	N	C	doub	1.32	N	Y
2	N1	C8A	N	C	sing	1.34	N	Y
3	C2	N2	C	N	sing	1.37	N	N
4	C2	N3	C	N	sing	1.36	N	Y
5	N2	HN21	N	H	sing	0.97	N	N
6	N2	HN22	N	H	sing	0.97	N	N
7	N3	C4	N	C	sing	1.35	N	Y
8	N3	HN3	N	H	sing	0.97	N	N
9	C4	O4	C	O	doub	1.22	N	N
10	C4	C4A	C	C	sing	1.4	N	Y
11	C4A	C8A	C	C	doub	1.39	N	Y
12	C4A	N5	C	N	sing	1.41	N	N
13	C8A	N8	C	N	sing	1.39	N	N
14	N5	C6	N	C	sing	1.47	N	N
15	N5	HN5	N	H	sing	0.97	N	N
16	N8	C7	N	C	sing	1.47	N	N
17	N8	HN8	N	H	sing	0.97	N	N
18	C6	C7	C	C	sing	1.54	N	N
19	C6	C9	C	C	sing	1.53	N	N
20	C6	H6	C	H	sing	1.09	N	N
21	C7	H71	C	H	sing	1.09	N	N
22	C7	H72	C	H	sing	1.09	N	N
23	C9	O9	C	O	sing	1.43	N	N
24	C9	C10	C	C	sing	1.53	N	N
25	C9	H9	C	H	sing	1.09	N	N
26	O9	HO9	O	H	sing	0.97	N	N
27	C10	C11	C	C	sing	1.53	N	N
28	C10	O10	C	O	sing	1.43	N	N
29	C10	H10	C	H	sing	1.09	N	N
30	C11	H111	C	H	sing	1.09	N	N
31	C11	H112	C	H	sing	1.09	N	N
32	C11	H113	C	H	sing	1.09	N	N
33	O10	HO0	O	H	sing	0.97	N	N

H4B : Used in PDB Entries

Total Number of PDB Entries: 640

Ligand Code	PDB Entry ID	Type	Total	Distinct
H4B	1d1v	Bound ligand	2	1
H4B	1d1w	Bound ligand	2	1
H4B	1d1x	Bound ligand	2	1
H4B	1df1	Bound ligand	2	1
H4B	1dm8	Bound ligand	2	1
H4B	1dwx	Bound ligand	2	1
H4B	1fop	Bound ligand	2	1
H4B	1j8u	Bound ligand	1	1
H4B	1jwj	Bound ligand	2	1
H4B	1k2r	Bound ligand	2	1
H4B	1k2s	Bound ligand	2	1
H4B	1k2t	Bound ligand	2	1
H4B	1k2u	Bound ligand	2	1
H4B	1kw0	Bound ligand	1	1
H4B	1lzx	Bound ligand	2	1
H4B	1lzz	Bound ligand	2	1
H4B	1m00	Bound ligand	2	1
H4B	1m8d	Bound ligand	2	1
H4B	1m8e	Bound ligand	2	1
H4B	1m8h	Bound ligand	2	1
H4B	1m8i	Bound ligand	2	1
H4B	1m9t	Bound ligand	2	1
H4B	1mmk	Bound ligand	1	1
H4B	1mmt	Bound ligand	1	1
H4B	1mmv	Bound ligand	2	1
H4B	1mmw	Bound ligand	2	1
H4B	1n2n	Bound ligand	2	1
H4B	1nod	Bound ligand	2	1
H4B	1nse	Bound ligand	2	1
H4B	1nsi	Bound ligand	4	1
H4B	1om4	Bound ligand	2	1
H4B	1om5	Bound ligand	2	1
H4B	1p6h	Bound ligand	2	1
H4B	1p6i	Bound ligand	2	1
H4B	1p6j	Bound ligand	2	1
H4B	1p6k	Bound ligand	2	1
H4B	1p6l	Bound ligand	2	1
H4B	1p6m	Bound ligand	2	1
H4B	1p6n	Bound ligand	2	1
H4B	1q2o	Bound ligand	2	1
H4B	1qom	Bound ligand	2	1
H4B	1qw4	Bound ligand	2	1
H4B	1qw5	Bound ligand	2	1
H4B	1qw6	Bound ligand	1	1
H4B	1qwc	Bound ligand	1	1
H4B	1r35	Bound ligand	2	1
H4B	1rs6	Bound ligand	2	1
H4B	1rs7	Bound ligand	2	1
H4B	1rs8	Bound ligand	2	1
H4B	1rs9	Bound ligand	2	1
H4B	1vaf	Bound ligand	2	1
H4B	1vag	Bound ligand	1	1
H4B	1zvi	Bound ligand	1	1
H4B	1zvl	Bound ligand	2	1
H4B	1zzq	Bound ligand	2	1
H4B	1zzr	Bound ligand	2	1
H4B	1zzs	Bound ligand	2	1
H4B	1zzt	Bound ligand	2	1
H4B	1zzu	Bound ligand	2	1
H4B	2an2	Bound ligand	1	1
H4B	2bfp	Bound ligand	4	1
H4B	2dtt	Bound ligand	6	1
H4B	2g6h	Bound ligand	2	1
H4B	2g6k	Bound ligand	2	1
H4B	2g6m	Bound ligand	2	1
H4B	2hx2	Bound ligand	2	1
H4B	2hx3	Bound ligand	2	1
H4B	2hx4	Bound ligand	2	1
H4B	2nod	Bound ligand	2	1
H4B	2nse	Bound ligand	2	1
H4B	2nsi	Bound ligand	4	1
H4B	2y37	Bound ligand	2	1
H4B	3b3m	Bound ligand	2	1
H4B	3b3n	Bound ligand	2	1
H4B	3b3o	Bound ligand	2	1
H4B	3b3p	Bound ligand	2	1
H4B	3dqr	Bound ligand	2	1
H4B	3dqs	Bound ligand	2	1
H4B	3dqt	Bound ligand	2	1
H4B	3dwj	Bound ligand	2	1
H4B	3e65	Bound ligand	2	1
H4B	3e67	Bound ligand	2	1
H4B	3e68	Bound ligand	2	1
H4B	3e6l	Bound ligand	2	1
H4B	3e6n	Bound ligand	2	1
H4B	3e6o	Bound ligand	2	1
H4B	3e6t	Bound ligand	2	1
H4B	3e7g	Bound ligand	4	1
H4B	3e7i	Bound ligand	2	1
H4B	3e7m	Bound ligand	2	1
H4B	3eai	Bound ligand	2	1
H4B	3ebd	Bound ligand	2	1
H4B	3ebf	Bound ligand	2	1
H4B	3ej8	Bound ligand	4	1
H4B	3fc5	Bound ligand	2	1
H4B	3hsn	Bound ligand	2	1
H4B	3hso	Bound ligand	2	1
H4B	3hsp	Bound ligand	2	1
H4B	3jt3	Bound ligand	2	1
H4B	3jt4	Bound ligand	2	1
H4B	3jt5	Bound ligand	2	1
H4B	3jt6	Bound ligand	2	1
H4B	3jt7	Bound ligand	2	1
H4B	3jt8	Bound ligand	2	1
H4B	3jt9	Bound ligand	2	1
H4B	3jta	Bound ligand	2	1
H4B	3jws	Bound ligand	2	1
H4B	3jwt	Bound ligand	2	1
H4B	3jwu	Bound ligand	2	1
H4B	3jwv	Bound ligand	2	1
H4B	3jww	Bound ligand	2	1
H4B	3jwx	Bound ligand	2	1
H4B	3jwy	Bound ligand	2	1
H4B	3jwz	Bound ligand	2	1
H4B	3jx0	Bound ligand	2	1
H4B	3jx1	Bound ligand	2	1
H4B	3jx2	Bound ligand	2	1
H4B	3jx3	Bound ligand	2	1
H4B	3jx4	Bound ligand	2	1
H4B	3jx5	Bound ligand	2	1
H4B	3jx6	Bound ligand	2	1
H4B	3n2r	Bound ligand	2	1
H4B	3n5p	Bound ligand	2	1
H4B	3n5q	Bound ligand	2	1
H4B	3n5r	Bound ligand	2	1
H4B	3n5s	Bound ligand	2	1
H4B	3n5t	Bound ligand	2	1
H4B	3n5v	Bound ligand	2	1
H4B	3n5y	Bound ligand	2	1
H4B	3n5z	Bound ligand	2	1
H4B	3n61	Bound ligand	2	1
H4B	3n62	Bound ligand	2	1
H4B	3n65	Bound ligand	2	1
H4B	3n67	Bound ligand	2	1
H4B	3n68	Bound ligand	2	1
H4B	3n69	Bound ligand	2	1
H4B	3n6a	Bound ligand	2	1
H4B	3n6b	Bound ligand	2	1
H4B	3n6c	Bound ligand	2	1
H4B	3n6d	Bound ligand	2	1
H4B	3n6e	Bound ligand	2	1
H4B	3n6f	Bound ligand	2	1
H4B	3n6g	Bound ligand	2	1
H4B	3nld	Bound ligand	2	1
H4B	3nle	Bound ligand	2	1
H4B	3nlf	Bound ligand	2	1
H4B	3nlg	Bound ligand	2	1
H4B	3nlh	Bound ligand	2	1
H4B	3nli	Bound ligand	2	1
H4B	3nlj	Bound ligand	2	1
H4B	3nlk	Bound ligand	2	1
H4B	3nlm	Bound ligand	2	1
H4B	3nln	Bound ligand	2	1
H4B	3nlo	Bound ligand	2	1
H4B	3nlp	Bound ligand	2	1
H4B	3nlq	Bound ligand	2	1
H4B	3nlr	Bound ligand	2	1
H4B	3nlt	Bound ligand	2	1
H4B	3nlu	Bound ligand	2	1
H4B	3nlv	Bound ligand	2	1
H4B	3nlw	Bound ligand	2	1
H4B	3nlx	Bound ligand	2	1
H4B	3nly	Bound ligand	2	1
H4B	3nlz	Bound ligand	2	1
H4B	3nm0	Bound ligand	2	1
H4B	3nny	Bound ligand	2	1
H4B	3nnz	Bound ligand	2	1
H4B	3nod	Bound ligand	2	1
H4B	3nos	Bound ligand	2	1
H4B	3nqs	Bound ligand	2	1
H4B	3nw2	Bound ligand	2	1
H4B	3pne	Bound ligand	2	1
H4B	3pnf	Bound ligand	2	1
H4B	3png	Bound ligand	2	1
H4B	3pnh	Bound ligand	2	1
H4B	3q99	Bound ligand	2	1
H4B	3q9a	Bound ligand	2	1
H4B	3rqj	Bound ligand	2	1
H4B	3rqk	Bound ligand	2	1
H4B	3rql	Bound ligand	2	1
H4B	3rqm	Bound ligand	2	1
H4B	3rqn	Bound ligand	2	1
H4B	3rqo	Bound ligand	2	1
H4B	3rqp	Bound ligand	2	1
H4B	3svp	Bound ligand	2	1
H4B	3svq	Bound ligand	2	1
H4B	3tyl	Bound ligand	2	1
H4B	3tym	Bound ligand	2	1
H4B	3tyn	Bound ligand	2	1
H4B	3tyo	Bound ligand	2	1
H4B	3ufo	Bound ligand	2	1
H4B	3ufp	Bound ligand	2	1
H4B	3ufq	Bound ligand	2	1
H4B	3ufr	Bound ligand	2	1
H4B	3ufs	Bound ligand	2	1
H4B	3uft	Bound ligand	2	1
H4B	3ufu	Bound ligand	2	1
H4B	3ufv	Bound ligand	2	1
H4B	3ufw	Bound ligand	2	1
H4B	4c39	Bound ligand	2	1
H4B	4c3a	Bound ligand	2	1
H4B	4cam	Bound ligand	2	1
H4B	4can	Bound ligand	2	1
H4B	4cao	Bound ligand	2	1
H4B	4cap	Bound ligand	2	1
H4B	4caq	Bound ligand	2	1
H4B	4car	Bound ligand	2	1
H4B	4cdt	Bound ligand	2	1
H4B	4cft	Bound ligand	2	1
H4B	4ctp	Bound ligand	2	1
H4B	4ctq	Bound ligand	2	1
H4B	4ctr	Bound ligand	2	1
H4B	4ctt	Bound ligand	2	1
H4B	4ctu	Bound ligand	2	1
H4B	4ctv	Bound ligand	2	1
H4B	4ctw	Bound ligand	2	1
H4B	4ctx	Bound ligand	2	1
H4B	4cty	Bound ligand	2	1
H4B	4ctz	Bound ligand	2	1
H4B	4cu0	Bound ligand	2	1
H4B	4cu1	Bound ligand	2	1
H4B	4cwv	Bound ligand	2	1
H4B	4cww	Bound ligand	2	1
H4B	4cwx	Bound ligand	2	1
H4B	4cwy	Bound ligand	2	1
H4B	4cwz	Bound ligand	2	1
H4B	4cx0	Bound ligand	2	1
H4B	4cx3	Bound ligand	2	1
H4B	4cx4	Bound ligand	2	1
H4B	4cx5	Bound ligand	2	1
H4B	4cx6	Bound ligand	2	1
H4B	4cx7	Bound ligand	4	1
H4B	4d1n	Bound ligand	4	1
H4B	4d1o	Bound ligand	2	1
H4B	4d1p	Bound ligand	2	1
H4B	4d2y	Bound ligand	2	1
H4B	4d2z	Bound ligand	2	1
H4B	4d30	Bound ligand	2	1
H4B	4d31	Bound ligand	2	1
H4B	4d32	Bound ligand	2	1
H4B	4d33	Bound ligand	2	1
H4B	4d34	Bound ligand	2	1
H4B	4d35	Bound ligand	2	1
H4B	4d36	Bound ligand	2	1
H4B	4d37	Bound ligand	2	1
H4B	4d38	Bound ligand	2	1
H4B	4d39	Bound ligand	2	1
H4B	4d3a	Bound ligand	2	1
H4B	4d3b	Bound ligand	2	1
H4B	4d7h	Bound ligand	1	1
H4B	4d7i	Bound ligand	1	1
H4B	4d7j	Bound ligand	1	1
H4B	4d7o	Bound ligand	2	1
H4B	4eux	Bound ligand	2	1
H4B	4fvw	Bound ligand	2	1
H4B	4fvx	Bound ligand	2	1
H4B	4fvy	Bound ligand	2	1
H4B	4fvz	Bound ligand	2	1
H4B	4fw0	Bound ligand	2	1
H4B	4gqe	Bound ligand	2	1
H4B	4imt	Bound ligand	2	1
H4B	4imu	Bound ligand	2	1
H4B	4imw	Bound ligand	2	1
H4B	4imx	Bound ligand	2	1
H4B	4js9	Bound ligand	2	1
H4B	4jse	Bound ligand	2	1
H4B	4jsf	Bound ligand	2	1
H4B	4jsg	Bound ligand	2	1
H4B	4jsh	Bound ligand	2	1
H4B	4jsi	Bound ligand	2	1
H4B	4jsj	Bound ligand	2	1
H4B	4jsk	Bound ligand	2	1
H4B	4jsl	Bound ligand	2	1
H4B	4jsm	Bound ligand	2	1
H4B	4k5d	Bound ligand	2	1
H4B	4k5e	Bound ligand	2	1
H4B	4k5f	Bound ligand	2	1
H4B	4k5g	Bound ligand	2	1
H4B	4k5h	Bound ligand	2	1
H4B	4k5i	Bound ligand	2	1
H4B	4k5j	Bound ligand	2	1
H4B	4k5k	Bound ligand	2	1
H4B	4kch	Bound ligand	2	1
H4B	4kci	Bound ligand	2	1
H4B	4kcj	Bound ligand	2	1
H4B	4kck	Bound ligand	2	1
H4B	4kcl	Bound ligand	2	1
H4B	4kcm	Bound ligand	2	1
H4B	4kcn	Bound ligand	2	1
H4B	4kco	Bound ligand	2	1
H4B	4kcp	Bound ligand	2	1
H4B	4kcq	Bound ligand	2	1
H4B	4kcr	Bound ligand	2	1
H4B	4kcs	Bound ligand	2	1
H4B	4luw	Bound ligand	2	1
H4B	4lux	Bound ligand	2	1
H4B	4lvx	Bound ligand	2	1
H4B	4lwb	Bound ligand	1	1
H4B	4nos	Bound ligand	3	1
H4B	4uch	Bound ligand	2	1
H4B	4ug5	Bound ligand	1	1
H4B	4ug6	Bound ligand	1	1
H4B	4ug7	Bound ligand	1	1
H4B	4ug8	Bound ligand	1	1
H4B	4uga	Bound ligand	1	1
H4B	4ugb	Bound ligand	1	1
H4B	4ugc	Bound ligand	1	1
H4B	4ugd	Bound ligand	1	1
H4B	4uge	Bound ligand	1	1
H4B	4ugf	Bound ligand	1	1
H4B	4ugg	Bound ligand	1	1
H4B	4ugh	Bound ligand	1	1
H4B	4ugj	Bound ligand	1	1
H4B	4ugk	Bound ligand	1	1
H4B	4ugl	Bound ligand	1	1
H4B	4ugm	Bound ligand	1	1
H4B	4ugn	Bound ligand	1	1
H4B	4ugo	Bound ligand	1	1
H4B	4ugp	Bound ligand	1	1
H4B	4ugq	Bound ligand	1	1
H4B	4ugr	Bound ligand	1	1
H4B	4ugs	Bound ligand	1	1
H4B	4ugt	Bound ligand	1	1
H4B	4ugu	Bound ligand	1	1
H4B	4ugv	Bound ligand	1	1
H4B	4ugw	Bound ligand	1	1
H4B	4ugx	Bound ligand	1	1
H4B	4ugy	Bound ligand	1	1
H4B	4ugz	Bound ligand	2	1
H4B	4uh0	Bound ligand	2	1
H4B	4uh1	Bound ligand	2	1
H4B	4uh2	Bound ligand	2	1
H4B	4uh3	Bound ligand	2	1
H4B	4uh4	Bound ligand	2	1
H4B	4uh5	Bound ligand	2	1
H4B	4uh6	Bound ligand	2	1
H4B	4uh7	Bound ligand	2	1
H4B	4uh8	Bound ligand	2	1
H4B	4uh9	Bound ligand	2	1
H4B	4uha	Bound ligand	2	1
H4B	4upm	Bound ligand	2	1
H4B	4upn	Bound ligand	2	1
H4B	4upo	Bound ligand	2	1
H4B	4upp	Bound ligand	2	1
H4B	4upq	Bound ligand	2	1
H4B	4upr	Bound ligand	2	1
H4B	4ups	Bound ligand	2	1
H4B	4upt	Bound ligand	2	1
H4B	4uqr	Bound ligand	1	1
H4B	4ux6	Bound ligand	1	1
H4B	4v3u	Bound ligand	4	1
H4B	4v3v	Bound ligand	2	1
H4B	4v3w	Bound ligand	2	1
H4B	4v3x	Bound ligand	2	1
H4B	4v3y	Bound ligand	2	1
H4B	4v3z	Bound ligand	2	1
H4B	5ad4	Bound ligand	2	1
H4B	5ad5	Bound ligand	2	1
H4B	5ad6	Bound ligand	2	1
H4B	5ad7	Bound ligand	2	1
H4B	5ad8	Bound ligand	2	1
H4B	5ad9	Bound ligand	2	1
H4B	5ada	Bound ligand	2	1
H4B	5adb	Bound ligand	2	1
H4B	5adc	Bound ligand	2	1
H4B	5add	Bound ligand	2	1
H4B	5ade	Bound ligand	2	1
H4B	5adf	Bound ligand	2	1
H4B	5adg	Bound ligand	2	1
H4B	5adi	Bound ligand	2	1
H4B	5adj	Bound ligand	2	1
H4B	5adk	Bound ligand	2	1
H4B	5adl	Bound ligand	2	1
H4B	5adm	Bound ligand	2	1
H4B	5adn	Bound ligand	2	1
H4B	5agk	Bound ligand	2	1
H4B	5agl	Bound ligand	2	1
H4B	5agm	Bound ligand	2	1
H4B	5agn	Bound ligand	2	1
H4B	5ago	Bound ligand	2	1
H4B	5agp	Bound ligand	2	1
H4B	5fj2	Bound ligand	2	1
H4B	5fj3	Bound ligand	2	1
H4B	5fvo	Bound ligand	1	1
H4B	5fvp	Bound ligand	2	1
H4B	5fvq	Bound ligand	2	1
H4B	5fvr	Bound ligand	2	1
H4B	5fvs	Bound ligand	2	1
H4B	5fvt	Bound ligand	2	1
H4B	5fvu	Bound ligand	2	1
H4B	5fvv	Bound ligand	2	1
H4B	5fvw	Bound ligand	2	1
H4B	5fvx	Bound ligand	2	1
H4B	5fvy	Bound ligand	2	1
H4B	5fvz	Bound ligand	2	1
H4B	5fw0	Bound ligand	2	1
H4B	5g0n	Bound ligand	2	1
H4B	5g0o	Bound ligand	2	1
H4B	5g0p	Bound ligand	2	1
H4B	5g67	Bound ligand	1	1
H4B	5g68	Bound ligand	1	1
H4B	5g69	Bound ligand	1	1
H4B	5g6a	Bound ligand	1	1
H4B	5g6c	Bound ligand	1	1
H4B	5g6d	Bound ligand	1	1
H4B	5g6e	Bound ligand	1	1
H4B	5g6f	Bound ligand	1	1
H4B	5g6g	Bound ligand	1	1
H4B	5g6h	Bound ligand	1	1
H4B	5g6i	Bound ligand	1	1
H4B	5g6k	Bound ligand	1	1
H4B	5g6l	Bound ligand	1	1
H4B	5g6m	Bound ligand	1	1
H4B	5g6n	Bound ligand	1	1
H4B	5g6q	Bound ligand	1	1
H4B	5unr	Bound ligand	2	1
H4B	5uns	Bound ligand	2	1
H4B	5unt	Bound ligand	2	1
H4B	5unu	Bound ligand	2	1
H4B	5unv	Bound ligand	2	1
H4B	5unw	Bound ligand	2	1
H4B	5unx	Bound ligand	2	1
H4B	5uny	Bound ligand	2	1
H4B	5unz	Bound ligand	2	1
H4B	5uo0	Bound ligand	2	1
H4B	5uo1	Bound ligand	2	1
H4B	5uo2	Bound ligand	2	1
H4B	5uo3	Bound ligand	2	1
H4B	5uo4	Bound ligand	2	1
H4B	5uo5	Bound ligand	2	1
H4B	5uo6	Bound ligand	2	1
H4B	5uo7	Bound ligand	2	1
H4B	5uo8	Bound ligand	4	1
H4B	5uo9	Bound ligand	4	1
H4B	5uoc	Bound ligand	4	1
H4B	5uod	Bound ligand	2	1
H4B	5vui	Bound ligand	2	1
H4B	5vuj	Bound ligand	2	1
H4B	5vuk	Bound ligand	2	1
H4B	5vul	Bound ligand	2	1
H4B	5vum	Bound ligand	2	1
H4B	5vun	Bound ligand	2	1
H4B	5vuo	Bound ligand	2	1
H4B	5vup	Bound ligand	2	1
H4B	5vuq	Bound ligand	2	1
H4B	5vur	Bound ligand	2	1
H4B	5vus	Bound ligand	2	1
H4B	5vut	Bound ligand	2	1
H4B	5vuu	Bound ligand	2	1
H4B	5vuv	Bound ligand	2	1
H4B	5vuw	Bound ligand	2	1
H4B	5vux	Bound ligand	2	1
H4B	5vuy	Bound ligand	2	1
H4B	5vuz	Bound ligand	2	1
H4B	5vv0	Bound ligand	2	1
H4B	5vv1	Bound ligand	2	1
H4B	5vv2	Bound ligand	2	1
H4B	5vv3	Bound ligand	2	1
H4B	5vv4	Bound ligand	2	1
H4B	5vv5	Bound ligand	2	1
H4B	5vv6	Bound ligand	2	1
H4B	5vv7	Bound ligand	2	1
H4B	5vv8	Bound ligand	2	1
H4B	5vv9	Bound ligand	2	1
H4B	5vva	Bound ligand	2	1
H4B	5vvb	Bound ligand	4	1
H4B	5vvc	Bound ligand	4	1
H4B	5vvd	Bound ligand	4	1
H4B	5vvg	Bound ligand	2	1
H4B	5vvn	Bound ligand	2	1
H4B	6auq	Bound ligand	2	1
H4B	6aur	Bound ligand	2	1
H4B	6aus	Bound ligand	2	1
H4B	6aut	Bound ligand	2	1
H4B	6auu	Bound ligand	2	1
H4B	6auv	Bound ligand	2	1
H4B	6auw	Bound ligand	2	1
H4B	6aux	Bound ligand	2	1
H4B	6auy	Bound ligand	2	1
H4B	6auz	Bound ligand	2	1
H4B	6av0	Bound ligand	2	1
H4B	6av1	Bound ligand	2	1
H4B	6av2	Bound ligand	2	1
H4B	6av3	Bound ligand	2	1
H4B	6av4	Bound ligand	2	1
H4B	6av5	Bound ligand	2	1
H4B	6av6	Bound ligand	4	1
H4B	6av7	Bound ligand	4	1
H4B	6cic	Bound ligand	2	1
H4B	6cid	Bound ligand	2	1
H4B	6cie	Bound ligand	4	1
H4B	6cif	Bound ligand	4	1
H4B	6hyc	Bound ligand	3	1
H4B	6ng1	Bound ligand	2	1
H4B	6ng2	Bound ligand	2	1
H4B	6ng4	Bound ligand	2	1
H4B	6ng5	Bound ligand	2	1
H4B	6ng6	Bound ligand	2	1
H4B	6ng7	Bound ligand	2	1
H4B	6ng8	Bound ligand	2	1
H4B	6nga	Bound ligand	2	1
H4B	6ngb	Bound ligand	2	1
H4B	6ngc	Bound ligand	2	1
H4B	6ngd	Bound ligand	2	1
H4B	6nge	Bound ligand	2	1
H4B	6ngf	Bound ligand	2	1
H4B	6ngh	Bound ligand	2	1
H4B	6ngi	Bound ligand	2	1
H4B	6ngj	Bound ligand	2	1
H4B	6ngk	Bound ligand	2	1
H4B	6ngl	Bound ligand	2	1
H4B	6ngm	Bound ligand	2	1
H4B	6ngn	Bound ligand	2	1
H4B	6ngp	Bound ligand	2	1
H4B	6ngq	Bound ligand	2	1
H4B	6ngr	Bound ligand	2	1
H4B	6ngs	Bound ligand	2	1
H4B	6ngt	Bound ligand	2	1
H4B	6ngu	Bound ligand	2	1
H4B	6ngv	Bound ligand	2	1
H4B	6ngw	Bound ligand	2	1
H4B	6ngx	Bound ligand	2	1
H4B	6ngy	Bound ligand	2	1
H4B	6ngz	Bound ligand	2	1
H4B	6nh0	Bound ligand	2	1
H4B	6nh1	Bound ligand	4	1
H4B	6nh2	Bound ligand	2	1
H4B	6nh4	Bound ligand	2	1
H4B	6nh5	Bound ligand	4	1
H4B	6nh6	Bound ligand	4	1
H4B	6nh8	Bound ligand	4	1
H4B	6nhb	Bound ligand	2	1
H4B	6nhc	Bound ligand	2	1
H4B	6nhd	Bound ligand	2	1
H4B	6nhe	Bound ligand	2	1
H4B	6nhf	Bound ligand	4	1
H4B	6pmv	Bound ligand	2	1
H4B	6pmw	Bound ligand	2	1
H4B	6pmx	Bound ligand	2	1
H4B	6pmy	Bound ligand	2	1
H4B	6pmz	Bound ligand	2	1
H4B	6pn0	Bound ligand	2	1
H4B	6pn1	Bound ligand	2	1
H4B	6pn2	Bound ligand	2	1
H4B	6pn3	Bound ligand	2	1
H4B	6pn4	Bound ligand	2	1
H4B	6pn5	Bound ligand	2	1
H4B	6pn6	Bound ligand	2	1
H4B	6pn7	Bound ligand	2	1
H4B	6pn8	Bound ligand	2	1
H4B	6pn9	Bound ligand	2	1
H4B	6pna	Bound ligand	2	1
H4B	6pnb	Bound ligand	2	1
H4B	6pnc	Bound ligand	2	1
H4B	6pnd	Bound ligand	2	1
H4B	6pne	Bound ligand	2	1
H4B	6pnf	Bound ligand	2	1
H4B	6po5	Bound ligand	2	1
H4B	6po7	Bound ligand	2	1
H4B	6po8	Bound ligand	2	1
H4B	6po9	Bound ligand	2	1
H4B	6poa	Bound ligand	2	1
H4B	6pob	Bound ligand	2	1
H4B	6pot	Bound ligand	2	1
H4B	6pov	Bound ligand	4	1
H4B	6pow	Bound ligand	2	1
H4B	6pox	Bound ligand	4	1
H4B	6poy	Bound ligand	4	1
H4B	6poz	Bound ligand	2	1
H4B	6pp0	Bound ligand	4	1
H4B	6pp1	Bound ligand	4	1
H4B	6pp2	Bound ligand	4	1
H4B	6pp3	Bound ligand	4	1
H4B	6pp4	Bound ligand	4	1
H4B	7m56	Bound ligand	2	1
H4B	7s3x	Bound ligand	2	1
H4B	7s3y	Bound ligand	2	1
H4B	7s3z	Bound ligand	2	1
H4B	7s40	Bound ligand	2	1
H4B	7ts1	Bound ligand	4	1
H4B	7ts2	Bound ligand	4	1
H4B	7ts3	Bound ligand	4	1
H4B	7ts4	Bound ligand	4	1
H4B	7ts5	Bound ligand	4	1
H4B	7ts6	Bound ligand	4	1
H4B	7ts7	Bound ligand	4	1
H4B	7ts8	Bound ligand	4	1
H4B	7ts9	Bound ligand	1	1
H4B	7tsa	Bound ligand	1	1
H4B	7tsb	Bound ligand	1	1
H4B	7tsc	Bound ligand	1	1
H4B	7tsd	Bound ligand	1	1
H4B	7tse	Bound ligand	1	1
H4B	7tsf	Bound ligand	2	1
H4B	7tsg	Bound ligand	4	1
H4B	7tsh	Bound ligand	4	1
H4B	7tsi	Bound ligand	4	1
H4B	7tsk	Bound ligand	4	1
H4B	7tsl	Bound ligand	4	1
H4B	7tsm	Bound ligand	4	1
H4B	7tsn	Bound ligand	4	1
H4B	7tso	Bound ligand	4	1
H4B	7tsp	Bound ligand	4	1
H4B	7uam	Bound ligand	4	1
H4B	7uan	Bound ligand	1	1
H4B	7uao	Bound ligand	4	1
H4B	7us7	Bound ligand	4	1
H4B	7us8	Bound ligand	4	1
H4B	7wif	Bound ligand	1	1
H4B	8fg9	Bound ligand	2	1
H4B	8fga	Bound ligand	2	1
H4B	8fgb	Bound ligand	2	1
H4B	8fgc	Bound ligand	2	1
H4B	8fgd	Bound ligand	1	1
H4B	8fge	Bound ligand	1	1
H4B	8fgf	Bound ligand	2	1
H4B	8fgg	Bound ligand	2	1
H4B	8fgh	Bound ligand	4	1
H4B	8fgi	Bound ligand	2	1
H4B	8fgj	Bound ligand	4	1
H4B	8fgk	Bound ligand	4	1
H4B	8fgl	Bound ligand	4	1
H4B	8fgm	Bound ligand	4	1
H4B	8fgn	Bound ligand	4	1
H4B	8fgo	Bound ligand	4	1
H4B	8fgp	Bound ligand	4	1
H4B	8fgq	Bound ligand	4	1
H4B	8fgr	Bound ligand	4	1
H4B	8fgs	Bound ligand	4	1
H4B	8fgt	Bound ligand	4	1
H4B	8fgu	Bound ligand	4	1
H4B	8fgv	Bound ligand	2	1
H4B	8nse	Bound ligand	2	1
H4B	8t1j	Bound ligand	2	1
H4B	8t1k	Bound ligand	2	1
H4B	8ufq	Bound ligand	4	1
H4B	8ufr	Bound ligand	4	1
H4B	8ufs	Bound ligand	4	1
H4B	8uft	Bound ligand	4	1
H4B	9nse	Bound ligand	2	1

Protein Data Bank
in Europe

Bringing Structure to Biology

Chemical Components in the PDB

H4B : Summary

Code

One-letter code

Molecule name

Systematic names

Formula

Formal charge

Molecular weight

SMILES

IUPAC InChI

IUPAC InChI key

wwPDB Information

Atom count

Polymer type

Type description

Type code

Is modified

Standard parent

Defined at

Last modified at

Status

Obsoleted

H4B : Atoms of Molecule

H4B : Chemical Bonds

H4B : Used in PDB Entries

EMBL-EBI

Services

Research

Training

Industry

About us

Protein Data Bank in Europe

Bringing Structure to Biology

Chemical Components in the PDB

H4B : Summary

Code

One-letter code

Molecule name

Systematic names

Formula

Formal charge

Molecular weight

SMILES

IUPAC InChI

IUPAC InChI key

wwPDB Information

Atom count

Polymer type

Type description

Type code

Is modified

Standard parent

Defined at

Last modified at

Status

Obsoleted

H4B : Atoms of Molecule

H4B : Chemical Bonds

H4B : Used in PDB Entries

EMBL-EBI

Services

Research

Training

Industry

About us

Protein Data Bank
in Europe