Structure of PDB 1h9w Chain B Binding Site BS02

Receptor Information

>1h9w Chain B (length=230) Species: 99571 (Dioclea guianensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

ADTIVAVELDSYPNTDIGDPSYPHIGIDIKSIRSKSTARWNMQTGKVGTA
HISYNSVAKRLSAVVSYTGSSSTTVSYDVDLNNVLPEWVRVGLSATTGLY
KETNTILSWSFTSKLKANSLHFSFNQFSQNPKDLILQGDATTDSDGNLEL
TKVSSSGDPQGSSVGRALFYAPVHIWEKSAVVASFDATFTFLIKSPDRDP
ADGITFFIANTDTSIPSGSGGRLLGLFPDA

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

1h9w Chain B Residue 239 [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	1h9w Crystal Structure of Native and Cd/Cd-Substituted Dioclea Guianensis Seed Lectin. A Novel Manganese-Binding Site and Structural Basis of Dimer-Tetramer Association
Resolution	2.0 Å
Binding residue (original residue number in PDB)	D10 Y12 N14 D19
Binding residue (residue number reindexed from 1)	D10 Y12 N14 D19
Annotation score	4

Enzymatic activity

Enzyme Commision number

Gene Ontology

	Molecular Function
GO:0005537	D-mannose binding
GO:0030246	carbohydrate binding
GO:0046872	metal ion binding
GO:0090729	toxin activity

	Biological Process
GO:0008150	biological_process
GO:0035821	modulation of process of another organism

	Cellular Component
GO:0005575	cellular_component

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Cellular Component

External links

PDB	RCSB:1h9w, PDBe:1h9w, PDBj:1h9w
PDBsum	1h9w
PubMed	11453695
UniProt	P81637\|LECA_DIOGU Lectin alpha chain

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