Structure of PDB 3so0 Chain D Binding Site BS01

Receptor Information
>3so0 Chain D (length=85) Species: 290402 (Clostridium beijerinckii NCIMB 8052) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AVTFYEDINYGGASVSLQPGNYTLSQLNTAKIPNDWMSSLKVPSGWTVDV
YENDNFTGTKWTYTSDTPWVGNDANDKMTSVKIYS
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 chain3so0 Chain D Residue 97 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB3so0 Decoding the molecular design principles underlying Ca(2+) binding to beta gamma-crystallin motifs
Resolution1.93 Å
Binding residue
(original residue number in PDB)		E9 W39 S41 D79
Binding residue
(residue number reindexed from 1)		E6 W36 S38 D76
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links