Structure of PDB 1xuo Chain A

Receptor sequence
>1xuoA (length=181) Species: 9606 (Homo sapiens) [Search protein sequence]
GNVDLVFLFDGSMSLQPDEFQKILDFMKDVMKKLSNTSYQFAAVQFSTSY
KTEFDFSDYVKWKDPDALLKHVKHMLLLTNTFGAINYVATEVFREELGAR
PDATKVLIIITDGEATDSGNIDAAKDIIRYIIGIGKHFQTKESQETLHKF
ASKPASEFVKILDTFEKLKDLFTELQKKIYV
3D structure
PDB1xuo 1,4-Diazepane-2,5-diones as novel inhibitors of LFA-1
ChainA
Resolution1.8 Å
3D
structure
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Enzymatic activity
Enzyme Commision number ?
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 MG A S139 S141 D239 S12 S14 D112
BS02 LA1 A F153 Y166 V233 Y257 L302 I306 V308 F26 Y39 V106 Y130 L175 I179 V181 MOAD: ic50=69nM
PDBbind-CN: -logKd/Ki=7.16,IC50=69nM
BindingDB: IC50=69nM
External links
PDB RCSB:1xuo, PDBe:1xuo, PDBj:1xuo
PDBsum1xuo
PubMed15686945
UniProtP20701|ITAL_HUMAN Integrin alpha-L (Gene Name=ITGAL)

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