Structure of PDB 4afb Chain A Binding Site BS01

Receptor Information

>4afb 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
GNYQAYAIWGSKTAKDELTVHLDAGVYYPIRLFYNNIGKDGALSFTFKTE
SNENTVSDFSEYFFSLDDTEEGCPGLI

Ligand information

Ligand ID

InChI

InChI=1S/Ca/q+2

InChIKey

BHPQYMZQTOCNFJ-UHFFFAOYSA-N

SMILES

Software	SMILES
CACTVS 3.341	[Ca++]
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Ca+2]

Formula

Name

CALCIUM ION

PDB chain

4afb 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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Structure summary

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PDB	4afb Structural Basis for Promiscuity and Specificity During Candida Glabrata Invasion of Host Epithelia.
Resolution	1.9 Å
Binding residue (original residue number in PDB)	D164 D165 N225 G227 D229 I266
Binding residue (residue number reindexed from 1)	D125 D126 N186 G188 D190 I227
Annotation score	4

Enzymatic activity

Enzyme Commision number

External links

PDB	RCSB:4afb, PDBe:4afb, PDBj:4afb
PDBsum	4afb
PubMed	23035251
UniProt	Q6VBJ0

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