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PDBsum entry 3k5k
Go to PDB code:
Ligand/metal interactions
PDB id
3k5k
2 instances of ligand highlighted
DXQ
Ligands
SAH
×2
SAH 1198(A)
DXQ
×2
DXQ 2000(A)
UNX
×2
UNX 1199(A)
Metals
_ZN
×8
ZN 1194(A)
ZN 1195(A)
ZN 1196(A)
ZN 1197(A)
_CL
×4
CL 3001(A)
CL 3004(A)
CL 3003(B)
Ligand
DXQ
-
7-[3-(Dimethylamino)propoxy]-6-Methoxy-2-(4-Methyl-1,4-
Diazepan-1-Yl)-N-(1-Methylpiperidin-4-Yl)quinazolin-4-
Amine
Formula:
C
26
H
43
N
7
O
2
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
DXQ 2000(A)
35
35
0
0
Complete
Chiral checks - OK
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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3D Viewers:
LIGPLOT
of interactions involving ligand DXQ
List of
interactions
DXQ 2000(A)
(also representing equivalent ligand DXQ 2001(B) )
_ZN
×8
_CL
×4
