Structure of PDB 7wwn Chain A Binding Site BS02

Receptor Information
>7wwn Chain A (length=159) Species: 300852 (Thermus thermophilus HB8) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PTAYALAISSLGEFNSLTGGTSTDPVAEGNDYYYRFEIRAWEGSSGPQTN
VTLNVTRTLGNSTFAGSGTKGVDFEVELDPDGPFGPASYAPVLSADVQVL
AWGPTGVQLRYLPSLAPGATLRFSLRANAVNTNTTVQADATSTEAPGPYT
VFETTTIIP
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7wwn Chain A Residue 202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7wwn Structure of the hypothetical protein TTHA1873 from Thermus thermophilus.
Resolution2.05 Å
Binding residue
(original residue number in PDB)		E29 D40 E170 T171
Binding residue
(residue number reindexed from 1)		E13 D24 E153 T154
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:7wwn, PDBe:7wwn, PDBj:7wwn
PDBsum7wwn
PubMed36048084
UniProtQ5SH57

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