Structure of PDB 5t20 Chain B Binding Site BS01

Receptor Information
>5t20 Chain B (length=109) Species: 4460 (Colocasia esculenta) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NIPFTDNLLFSGQVLYGDGRLTAKNHQLVMQGDCNLVLYGGKYGWQSNTH
GNGEHCFLRLNHKGELIIKDDDFKTIWSSNSSSKQGDYVLILRDDGFAVI
YGPAIWETS
Ligand information
Ligand IDMAN
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-PQMKYFCFSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.341OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341OC[C@H]1O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O)O
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-mannopyranose;
alpha-D-mannose;
D-mannose;
mannose
ChEMBLCHEMBL365590
DrugBank
ZINCZINC000003860903
PDB chain5t20 Chain R Residue 1 [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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PDB5t20 High-resolution crystal structures of Colocasia esculenta tarin lectin.
Resolution1.91 Å
Binding residue
(original residue number in PDB)		Q31 D33 N35 Y39 Q46
Binding residue
(residue number reindexed from 1)		Q31 D33 N35 Y39 Q46
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5t20, PDBe:5t20, PDBj:5t20
PDBsum5t20
PubMed27558840
UniProtQ39487|LEC1_COLES Mannose-specific lectin 1

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