Structure of PDB 4mti Chain A

Receptor sequence
>4mtiA (length=94) Species: 9606 (Homo sapiens) [Search protein sequence]
SSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFC
CDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRY
3D structure
PDB4mti Design, synthesis, and biological activities of novel hexahydropyrazino[1,2-a]indole derivatives as potent inhibitors of apoptosis (IAP) proteins antagonists with improved membrane permeability across MDR1 expressing cells.
ChainA
Resolution2.15 Å
3D
structure
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Enzymatic activity
Enzyme Commision number 2.3.2.27: RING-type E3 ubiquitin transferase.
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 ZN A C300 C303 H320 C327 C48 C51 H68 C75
BS02 2DX A D297 G306 L307 R308 C309 W310 D314 E319 W323 D45 G54 L55 R56 C57 W58 D62 E67 W71 MOAD: ic50=1.2nM
PDBbind-CN: -logKd/Ki=8.92,IC50=1.2nM
External links
PDB RCSB:4mti, PDBe:4mti, PDBj:4mti
PDBsum4mti
PubMed24169315
UniProtQ13490|BIRC2_HUMAN Baculoviral IAP repeat-containing protein 2 (Gene Name=BIRC2)

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