Structure of PDB 4afa Chain A Binding Site BS02

Receptor Information
>4afa Chain A (length=227) Species: 5478 (Nakaseomyces glabratus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKDPTTFPLGCSPDITTPKKGLSMELYSYDFRKKGSYPCWDAAYLDPNYP
RTGYKSHRLLAKVDGVTGNINFYYHATKGCTPQLGHLPASYNYPKPLTMT
NFTMLLYGYFRPKVTGFHTFTISADDLLFVNFGAGNAFDCCRRDSSADHF
GNYQAYAIWGSKTAKDELTVHLDAGVYYPIRLFYNNRDNNGALSFTFKTE
SNENTVSDFSEYFFSLDDTEEGCPGLI
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 chain4afa Chain A Residue 1267 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4afa Structural Basis for Promiscuity and Specificity During Candida Glabrata Invasion of Host Epithelia.
Resolution2.05 Å
Binding residue
(original residue number in PDB)		D164 D165 N225 D227 N229
Binding residue
(residue number reindexed from 1)		D125 D126 N186 D188 N190
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links