Structure of PDB 8rhi Chain B Binding Site BS03

Receptor Information
>8rhi Chain B (length=273) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HHHSSGENLYFQGIWDRMRDGFQLQDAISTNPRIERQRLWFLSNQSFLEQ
SSARGSLYMHYVVERLEERNMPLELALLPVIESAYNPFALSRSNAAGLWQ
FIPATGQHFNLRQTNFYDGRRDITASTNAALTYLERLHDMFNGDWMLALA
AYNAGEGTVSRAIERNEKLGLPTDYWNLPLPQETQDYVPKLLALSQIVMA
PDSYGISLNPINNEPYFQAVRVKRGIDLSSVAALANLDEDELYQLNPAYK
RRVTMDQQLLVPMEKAAFLTASL
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 chain8rhi Chain B Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8rhi Structural characterization of lytic transglycosylase MltD of Pseudomonas aeruginosa, a target for the natural product bulgecin A.
Resolution1.98 Å
Binding residue
(original residue number in PDB)		H63 H65 E69 D82
Binding residue
(residue number reindexed from 1)		H1 H3 E7 D20
Annotation score4
Enzymatic activity
Enzyme Commision number 4.2.2.-
Gene Ontology
Molecular Function
GO:0008933 lytic transglycosylase activity
Biological Process
GO:0000270 peptidoglycan metabolic process
Cellular Component
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:8rhi, PDBe:8rhi, PDBj:8rhi
PDBsum8rhi
PubMed38583835
UniProtQ9I2T2

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