Structure of PDB 6li7 Chain A Binding Site BS04

Receptor Information
>6li7 Chain A (length=337) Species: 5322 (Pleurotus ostreatus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KITATPSQFQPALLNASKWIWTGENPIPGGSNIISTRPFRKNITAPCGKC
SVCATIVVASDDAHTFYVNGVRIGTGAGFRQGQALFVALQPTWNLFAIAG
QNLVANSPAGIMASILVHFSDGTSETFVTDESWKTLRAAPPENFQLPSTN
DSNWPSAAVQGAYQNSVWGPPVLPPVLPLRGSNWIWTSDNVNGAAPVGSR
AFRKTVNQCTKVAVCATVLIAADDRYTLYVNGATVGSGSSYTVADAYTIP
NLHPTFNTFAINATNGGGPAGVIATILITYSDGSNETVVTDASWKAIQTI
PQGFQPPLIDEFGWESAKIIGAFGVAPWGAGMVIPSA
Ligand information
Ligand IDGOL
InChIInChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKeyPEDCQBHIVMGVHV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(C(CO)O)O
ACDLabs 12.01
CACTVS 3.370		OCC(O)CO
FormulaC3 H8 O3
NameGLYCEROL;
GLYCERIN;
PROPANE-1,2,3-TRIOL
ChEMBLCHEMBL692
DrugBankDB09462
ZINCZINC000000895048
PDB chain6li7 Chain A Residue 410 [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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PDB6li7 Crystallographic and calorimetric analysis on Pleurotus ostreatus lectin and its sugar complexes - promiscuous binding driven by geometry.
Resolution2.098 Å
Binding residue
(original residue number in PDB)		D97 D98 V140 S143 P144
Binding residue
(residue number reindexed from 1)		D61 D62 V104 S107 P108
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links