Structure of PDB 8p9q Chain A Binding Site BS01
Receptor Information
>8p9q Chain A (length=233) Species:
287
(Pseudomonas aeruginosa) [
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PSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGD
ELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRA
AGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAA
HSTDNLVVYVPSANVLYGGCAVHELSSTSAGNVADADLAEWPTSVERIQK
HYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKN
Ligand information
Ligand ID
ZN
InChI
InChI=1S/Zn/q+2
InChIKey
PTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
Formula
Zn
Name
ZINC ION
ChEMBL
CHEMBL1236970
DrugBank
DB14532
ZINC
PDB chain
8p9q Chain A Residue 301 [
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Receptor-Ligand Complex Structure
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PDB
8p9q
Crystal structure of the metallo-beta-lactamase VIM1 with 2455
Resolution
1.08 Å
Binding residue
(original residue number in PDB)
H114 H116 H179
Binding residue
(residue number reindexed from 1)
H86 H88 H151
Annotation score
1
External links
PDB
RCSB:8p9q
,
PDBe:8p9q
,
PDBj:8p9q
PDBsum
8p9q
PubMed
UniProt
Q9XAY4
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