Structure of PDB 6jkw Chain B Binding Site BS02
Receptor Information
>6jkw Chain B (length=372) Species:
470
(Acinetobacter baumannii) [
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AGGKVTSSTGIAPKRYVYYPGSEELGPDEIRVIACGTGMPTARRAQAAAA
WVVELGNGDKFIVDIGSGSMANIQSLMIPANYLTKIFLTHLHTDHWGDLV
SMWAGGWTAGRTDPLEVWGPSGSREDMGTKYAVEHMLKAYNWDYMTRAVT
INPRPGDINVHEFDYRALNEVVYQENGVTFRSWPCIHAGDGPVSFALEWN
GYKVVFGGDTAPNIWYPEYAKGADLAIHECWMTSDQMMTKYNQPAQLALR
INLDFHTSAQSFGQIMNMVQPRHAVAYHFFNDDDTRYDIYTGVRENYAGP
LSMATDMMVWNITRDAVTERMAVSPDHAWDVAGPSEDLAPDRNRASEYTQ
YILDGRLNVDEANAHWKQEFMG
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
6jkw Chain B Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
6jkw
PNGM 1 a novel subclass B3 metallo beta lactamase from a deep sea sediment metagenome
Resolution
2.29 Å
Binding residue
(original residue number in PDB)
H91 H93 H188 D210
Binding residue
(residue number reindexed from 1)
H90 H92 H187 D209
Annotation score
4
External links
PDB
RCSB:6jkw
,
PDBe:6jkw
,
PDBj:6jkw
PDBsum
6jkw
PubMed
29842976
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