Structure of PDB 7jjb Chain A Binding Site BS01

Receptor Information
>7jjb Chain A (length=180) Species: 171101 (Streptococcus pneumoniae R6) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DTKTVQNGYFEDAAVKDRTLSDYAGNWQSVYPFLEDGTFDQVFDYKAKLT
GKMTQAEYKAYYTKGYQTDVTKINITDNTMEFVQGGQSKKYTYKYVGKKI
LTYKKGNRGVRFLFEATDADAGQFKYVQFSDHNIAPVKAEHFHIFFGGTS
QETLFEEMDNWPTYYPDNLSGQEIAQEMLA
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 chain7jjb Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7jjb A Trap-Door Mechanism for Zinc Acquisition by Streptococcus pneumoniae AdcA.
Resolution1.1 Å
Binding residue
(original residue number in PDB)		H131 H140 H142
Binding residue
(residue number reindexed from 1)		H132 H141 H143
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008270 zinc ion binding

View graph for
Molecular Function
External links
PDB RCSB:7jjb, PDBe:7jjb, PDBj:7jjb
PDBsum7jjb
PubMed33531394
UniProtQ8CWN2|ADCA_STRR6 Zinc-binding lipoprotein AdcA (Gene Name=adcA)

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