Structure of PDB 1bc2 Chain B Binding Site BS01
Receptor Information
>1bc2 Chain B (length=216) Species:
1396
(Bacillus cereus) [
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TVIKNETGTISISQLNKNVWVHTELGAVPSNGLVLNTSKGLVLVDSSWDD
KLTKELIEMVEKKFQKRVTDVIITHAHADRIGGIKTLKERGIKAHSTALT
AELAKKNGYEEPLGDLQTVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQY
NILVGGCLVKSTSAKDLGNVADAYVNEWSTSIENVLKRYRNINAVVPGHG
EVGDKGLLLHTLDLLK
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
1bc2 Chain B Residue 228 [
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Receptor-Ligand Complex Structure
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PDB
1bc2
Crystal structure of the zinc-dependent beta-lactamase from Bacillus cereus at 1.9 A resolution: binuclear active site with features of a mononuclear enzyme.
Resolution
1.9 Å
Binding residue
(original residue number in PDB)
H86 H88 H149
Binding residue
(residue number reindexed from 1)
H75 H77 H138
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
H86 H88 D90 H149 C168 K171 N180 H210
Catalytic site (residue number reindexed from 1)
H75 H77 D79 H138 C157 K160 N169 H199
Enzyme Commision number
3.5.2.6
: beta-lactamase.
Gene Ontology
Molecular Function
GO:0008270
zinc ion binding
GO:0008800
beta-lactamase activity
GO:0016787
hydrolase activity
GO:0046872
metal ion binding
Biological Process
GO:0017001
antibiotic catabolic process
GO:0046677
response to antibiotic
Cellular Component
GO:0042597
periplasmic space
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:1bc2
,
PDBe:1bc2
,
PDBj:1bc2
PDBsum
1bc2
PubMed
9730812
UniProt
P04190
|BLA2_BACCE Metallo-beta-lactamase type 2 (Gene Name=blm)
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