Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : TFY

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 85


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 O31 O O31 N N N 0 -3.087 0.782 -0.325
2 C27 C C27 S N N 0 -3.782 0.019 0.663
3 C26 C C26 S N N 0 -5.082 -0.534 0.069
4 C30 C C30 N N N 0 -5.944 0.625 -0.434
5 C32 C C32 N N N 0 -6.377 1.491 0.752
6 N33 N N33 N Y N 0 -7.203 2.601 0.27
7 C37 C C37 N Y N 0 -8.443 2.914 0.689
8 N36 N N36 N Y N 0 -8.815 3.969 0.005
9 N35 N N35 N Y N 0 -7.854 4.286 -0.793
10 N34 N N34 N Y N 0 -6.876 3.465 -0.631
11 C25 C C25 R N N 0 -4.761 -1.472 -1.096
12 O29 O O29 N N N 0 -5.976 -1.866 -1.736
13 C24 C C24 N N N 0 -4.033 -2.715 -0.576
14 C28 C C28 N N N 0 -2.923 -1.15 1.103
15 C39 C C39 N N N 0 -2.327 -1.17 2.295
16 C23 C C23 N N N 0 -2.778 -2.267 0.146
17 C11 C C11 N N N 0 -1.586 -2.858 -0.074
18 C10 C C10 N N N 0 -0.395 -2.397 0.643
19 C4 C C4 N N N 0 0.783 -2.981 0.425
20 C3 C C3 N N N 0 0.953 -4.132 -0.556
21 C2 C C2 N N N 0 2.112 -3.86 -1.513
22 C5 C C5 S N N 0 2.036 -2.548 1.125
23 C8 C C8 N N N 0 1.96 -1.244 1.922
24 C9 C C9 N N N 0 3.443 -0.78 1.965
25 C7 C C7 R N N 0 4.14 -1.434 0.743
26 C6 C C6 R N N 0 3.03 -2.155 -0.005
27 C13 C C13 N N N 0 2.345 -1.173 -0.957
28 C1 C C1 N N N 0 3.377 -3.411 -0.763
29 C14 C C14 R N N 0 4.77 -0.361 -0.147
30 C16 C C16 N N N 0 5.42 -1.023 -1.363
31 C15 C C15 N N N 0 5.833 0.401 0.648
32 C17 C C17 N N N 0 6.375 1.554 -0.2
33 C18 C C18 N N N 0 7.438 2.315 0.594
34 C19 C C19 N N N 0 7.98 3.468 -0.254
35 O22 O O22 N N N 0 8.562 2.946 -1.45
36 C21 C C21 N N N 0 6.835 4.417 -0.615
37 C20 C C20 N N N 0 9.043 4.229 0.54
38 H1 H H1 N N N 0 -2.246 1.148 -0.02
39 H2 H H2 N N N 0 -4.01 0.651 1.522
40 H3 H H3 N N N 0 -5.626 -1.083 0.837
41 H4 H H4 N N N 0 -5.368 1.23 -1.134
42 H5 H H5 N N N 0 -6.827 0.23 -0.936
43 H6 H H6 N N N 0 -6.953 0.886 1.452
44 H7 H H7 N N N 0 -5.494 1.886 1.254
45 H8 H H8 N N N 0 -9.019 2.398 1.442
46 H9 H H9 N N N 0 -4.126 -0.953 -1.814
47 H10 H H10 N N N 0 -5.85 -2.463 -2.486
48 H11 H H11 N N N 0 -4.679 -3.258 0.114
49 H12 H H12 N N N 0 -3.765 -3.361 -1.412
50 H13 H H13 N N N 0 -2.451 -0.339 2.974
51 H14 H H14 N N N 0 -1.721 -2.016 2.582
52 H15 H H15 N N N 0 -1.509 -3.673 -0.78
53 H16 H H16 N N N 0 -0.472 -1.583 1.349
54 H17 H H17 N N N 0 1.153 -5.05 -0.002
55 H18 H H18 N N N 0 0.034 -4.253 -1.13
56 H19 H H19 N N N 0 2.333 -4.77 -2.071
57 H20 H H20 N N N 0 1.818 -3.077 -2.213
58 H21 H H21 N N N 0 2.44 -3.358 1.734
59 H22 H H22 N N N 0 1.341 -0.511 1.404
60 H23 H H23 N N N 0 1.58 -1.427 2.927
61 H24 H H24 N N N 0 3.498 0.306 1.89
62 H25 H H25 N N N 0 3.914 -1.116 2.889
63 H26 H H26 N N N 0 4.898 -2.143 1.075
64 H27 H H27 N N N 0 2.157 -0.234 -0.437
65 H28 H H28 N N N 0 2.991 -0.99 -1.816
66 H29 H H29 N N N 0 1.4 -1.596 -1.297
67 H30 H H30 N N N 0 3.697 -4.187 -0.068
68 H31 H H31 N N N 0 4.173 -3.203 -1.479
69 H32 H H32 N N N 0 3.999 0.334 -0.48
70 H33 H H33 N N N 0 4.662 -1.566 -1.929
71 H34 H H34 N N N 0 5.868 -0.259 -1.997
72 H35 H H35 N N N 0 6.191 -1.718 -1.03
73 H36 H H36 N N N 0 5.389 0.799 1.56
74 H37 H H37 N N N 0 6.648 -0.275 0.905
75 H38 H H38 N N N 0 6.819 1.156 -1.113
76 H39 H H39 N N N 0 5.56 2.23 -0.458
77 H40 H H40 N N N 0 6.994 2.713 1.507
78 H41 H H41 N N N 0 8.253 1.639 0.851
79 H42 H H42 N N N 0 9.295 2.335 -1.297
80 H43 H H43 N N N 0 6.392 4.815 0.298
81 H44 H H44 N N N 0 7.221 5.238 -1.219
82 H45 H H45 N N N 0 6.078 3.874 -1.181
83 H46 H H46 N N N 0 9.858 3.553 0.798
84 H47 H H47 N N N 0 9.429 5.05 -0.064
85 H48 H H48 N N N 0 8.599 4.627 1.453