Structure of PDB 2pr7 Chain B Binding Site BS01

Receptor Information
>2pr7 Chain B (length=137) Species: 196627 (Corynebacterium glutamicum ATCC 13032) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GMRGLIVDYAGVLDGTDEDQRRWRNLLAAAKKNGVGTVILSNDPGGLGAA
PIRELETNGVVDKVLLSGELGVEKPEEAAFQAAADAIDLPMRDCVLVDDS
ILNVRGAVEAGLVGVYYQQFDRAVVEIVGLFGLEGEF
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 chain2pr7 Chain B Residue 137 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2pr7 Crystal structure of uncharacterized protein (NP_599989.1) from Corynebacterium glutamicum ATCC 13032 Kitasato at 1.44 A resolution
Resolution1.44 Å
Binding residue
(original residue number in PDB)		D7 A9 D98
Binding residue
(residue number reindexed from 1)		D8 A10 D99
Annotation score4
External links