Structure of PDB 4on1 Chain A Binding Site BS01
Receptor Information
>4on1 Chain A (length=334) Species:
817
(Bacteroides fragilis) [
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PQLEHVLNLRSMDYEDLAGVLSKISNTEHTIMLQEGSELWTTSIKAIHGV
EIEESNRPVYLFEGQDKDSINAILSQSYATIRLQRGGDLIDYIVYKDKER
MAEIANYYQNHYLDKIVVCNTGDIKNIRIDITKAIGNNPFKGLPIKDYPT
EATYPATLEFMLIKEKDGGSLEHDITSQIQAVTTSLKFLIDSGFITVKYT
IKDSSHKGGASDYEVSALESFQNYLRSWDEVKGQDKKPYILLRDGTWDSG
KTFGYASGIGVIHLNNPRGNFEVAAISTTSSSHPYTLAHEIGHLLGAEHV
DNEQDLMYTWYSPQVTPNHLSADNWVRMLECIQK
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
4on1 Chain A Residue 400 [
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Receptor-Ligand Complex Structure
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PDB
4on1
Structural and functional diversity of metalloproteinases encoded by the Bacteroides fragilis pathogenicity island.
Resolution
2.13 Å
Binding residue
(original residue number in PDB)
D193 H351 H355 H361
Binding residue
(residue number reindexed from 1)
D147 H289 H293 H299
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0004222
metalloendopeptidase activity
GO:0008237
metallopeptidase activity
GO:0008270
zinc ion binding
Biological Process
GO:0006508
proteolysis
Cellular Component
GO:0031012
extracellular matrix
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:4on1
,
PDBe:4on1
,
PDBj:4on1
PDBsum
4on1
PubMed
24698179
UniProt
O68424
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