Structure of PDB 4aiz Chain C Binding Site BS01

Receptor Information
>4aiz Chain C (length=107) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
YELMQPPSVSVSPGQTARITCSGDALPKQYAYWYQQKPGQAPVLVIYKDS
ERPSGIPERFSGSSSGTTVTLTISGVQAEDEADYYCQSADSSGTYVVFGG
GTKLTVL
Ligand information
Ligand ID88Q
InChIInChI=1S/C12H22O6/c13-5-11(15)3-1-9(17-7-11)10-2-4-12(16,6-14)8-18-10/h9-10,13-16H,1-8H2/t9-,10-,11-,12-/m0/s1
InChIKeyFJMBBGDZFKPKCM-BJDJZHNGSA-N
SMILES
SoftwareSMILES
CACTVS 3.385OC[C@@]1(O)CC[C@H](OC1)[C@@H]2CC[C@](O)(CO)CO2
ACDLabs 12.01OCC1(O)CCC(OC1)C2OCC(O)(CO)CC2
OpenEye OEToolkits 1.9.2C1C[C@@](CO[C@@H]1[C@@H]2CC[C@@](CO2)(CO)O)(CO)O
OpenEye OEToolkits 1.9.2C1CC(COC1C2CCC(CO2)(CO)O)(CO)O
CACTVS 3.385OC[C]1(O)CC[CH](OC1)[CH]2CC[C](O)(CO)CO2
FormulaC12 H22 O6
Name1,5:6,10-dianhydro-3,4,7,8-tetradeoxy-2,9-bis-C-(hydroxymethyl)-L-manno-decitol
ChEMBL
DrugBank
ZINCZINC000095920657
PDB chain4aiz Chain D Residue 1109 [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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PDB4aiz Site-Directed Mutagenesis Reveals Regions Implicated in the Stability and Fiber Formation of Human Lambda3R Light Chains.
Resolution1.75 Å
Binding residue
(original residue number in PDB)		Q37 Y86
Binding residue
(residue number reindexed from 1)		Q36 Y85
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Cellular Component
GO:0005576 extracellular region

View graph for
Cellular Component
External links
PDB RCSB:4aiz, PDBe:4aiz, PDBj:4aiz
PDBsum4aiz
PubMed25505244
UniProtQ5NV90

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