Structure of PDB 7x2s Chain A Binding Site BS04

Receptor Information

>7x2s Chain A (length=340) Species: 2011797 (Leptobacillium sp.) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

VKLPLPQRLLHDWANGSWVENISVRPNGNLLVSTSTPDGSVWQIKEPWKD
QPEVELVYNFDQWVDRLIGIGETTPDKYVVVGSRFYSTDPMSSHVDRTFA
AMELDFSGSANKDKPAVRLIAWFPDAHLLQGVAALPWDRTKVLISDQYLL
RPRAAPQKDWTPARGQVWTLDTVTGAHEVVFANDTALDTTYRHGYDVGIN
GIKIRRDWLYWVNSDDGNIYRLKIDKTGHAVPPAKPEVVAFQDTIWDDFT
FGPEHEDTIWATGFNAIFAASPQGKVVTVNGVGTSDNGIMPGPTACAFGR
SPHDRNILYVTGNMGEIPVDIEHVHLKGWVRAIDTTGFHF

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

7x2s Chain A Residue 409 [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	7x2s Calcium-dependent glycosylated enzyme in the tandem hetero-Diels-Alder reaction
Resolution	1.92 Å
Binding residue (original residue number in PDB)	E48 Q158 N228 D275
Binding residue (residue number reindexed from 1)	E20 Q130 N200 D247
Annotation score	4

External links

PDB	RCSB:7x2s, PDBe:7x2s, PDBj:7x2s
PDBsum	7x2s
PubMed

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