Structure of PDB 3hi6 Chain A Binding Site BS01

Receptor Information
>3hi6 Chain A (length=180) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GNVDLVFLFDGSMSLQPDEFQKILDFMKDVMKKCSNTSYQFAAVQFSTSY
KTEFDFSDYVKWKDPDALLKHVKHMLLLTNTFGAINYVATEVFREELGAR
PDATKVLIIITDGEATDSGNIDAAKDIIRYIIGIGKHFQTKESQETLHKF
ASKPASEFVKILDTFEKLKDLCTELQKKIY
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain3hi6 Chain A 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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PDB3hi6 Structural basis of activation-dependent binding of ligand-mimetic antibody AL-57 to integrin LFA-1.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		S139 S141 T206
Binding residue
(residue number reindexed from 1)		S12 S14 T79
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:3hi6, PDBe:3hi6, PDBj:3hi6
PDBsum3hi6
PubMed19805116
UniProtP20701|ITAL_HUMAN Integrin alpha-L (Gene Name=ITGAL)

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