Structure of PDB 8cr4 Chain A Binding Site BS01

Receptor Information
>8cr4 Chain A (length=298) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AQAGGPGGNQKIGKYNYGTDYGPLIVNDRCEMDDGNVITVDMNGSTNDSK
STPFRFACPTNTYKQINGAYSPLNDAHFFGGVVFNLYKDWFGASPLTHKL
YMKVHYGRSVENAYWDGTAVLFGDGATMFYPLVSLDVAAHEVSHGFTEQN
SGLVYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYM
DQPSRDGRSIDNAGQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEV
FVDANRYYWTATSTFNSGACGVISSAQNRNYPAADVTRAFSTVGVTCP
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain8cr4 Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB8cr4 Facile Production of the Pseudomonas aeruginosa Virulence Factor LasB in Escherichia coli for Structure-Based Drug Design.
Resolution0.91 Å
Binding residue
(original residue number in PDB)		H140 H144 E164
Binding residue
(residue number reindexed from 1)		H140 H144 E164
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.24.26: pseudolysin.
Gene Ontology
Molecular Function
GO:0004175 endopeptidase activity
GO:0004222 metalloendopeptidase activity
GO:0008237 metallopeptidase activity
GO:0046872 metal ion binding
Biological Process
GO:0006508 proteolysis
GO:0015628 protein secretion by the type II secretion system
GO:0043952 protein transport by the Sec complex
GO:0044010 single-species biofilm formation
GO:0071978 bacterial-type flagellum-dependent swarming motility
Cellular Component
GO:0005576 extracellular region

View graph for
Molecular Function
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB RCSB:8cr4, PDBe:8cr4, PDBj:8cr4
PDBsum8cr4
PubMed37195753
UniProtP14756|ELAS_PSEAE Elastase (Gene Name=lasB)

[Back to BioLiP]