Structure of PDB 2sba Chain A Binding Site BS01

Receptor Information
>2sba Chain A (length=231) Species: 3847 (Glycine max) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AETVSFSWNKFVPKQPNMILQGDAIVTSSGKLQLNKVDENGTPKPSSLGR
ALYSTPIHIWDKETGSVASFAASFNFTFYAPDTKRLADGLAFFLAPIDTK
PQTHAGYLGLFNENDQVVAVEFDTFRNSWDPPNPHIGINVNSIRSIKTTS
WDLANNKVAKVLITYDASTSLLVASLVYPSQRTSNILSDVVDLKTSLPEW
VRIGFSAATGLDIPGESHDVLSWSFASNLPH
Ligand information
Ligand IDGAL
InChIInChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1
InChIKeyWQZGKKKJIJFFOK-FPRJBGLDSA-N
SMILES
SoftwareSMILES
CACTVS 3.370OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
OpenEye OEToolkits 1.7.2C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.370OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
ACDLabs 12.01OC1C(O)C(OC(O)C1O)CO
OpenEye OEToolkits 1.7.2C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
FormulaC6 H12 O6
Namebeta-D-galactopyranose;
beta-D-galactose;
D-galactose;
galactose
ChEMBLCHEMBL300520
DrugBank
ZINCZINC000002597049
PDB chain2sba Chain B Residue 2 [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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PDB2sba X-ray crystal structure of the soybean agglutinin cross-linked with a biantennary analog of the blood group I carbohydrate antigen.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		D88 G106 F128 L214 D215 I216
Binding residue
(residue number reindexed from 1)		D88 G106 F125 L211 D212 I213
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding

View graph for
Molecular Function
External links
PDB RCSB:2sba, PDBe:2sba, PDBj:2sba
PDBsum2sba
PubMed7711015
UniProtP05046|LEC_SOYBN Lectin (Gene Name=LE1)

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