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Ligands
Code Name Style Show Link
FES Fe2/s2 (inorganic) cluster
RMT (3r,4e)-4-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)imino]cyclopent-1-ene-1,3-dicarboxylic acid
ACT Acetate ion
GOL Glycerol
Non-standard Residues
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Code : 6B6G   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE
Title : Crystal Structure of GABA Aminotransferase bound to (S)-3-Amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid, an Potent Inactivatorfor the Treatment of Addiction
Release Data : 2018-02-14
Compound :
mol_id molecule chains synonym
1 4-aminobutyrate aminotransferase, mitochondrial A,B,C,D (S)-3-amino-2-methylpropionate transaminase,GABA aminotransferase,GABA-AT,Gamma-amino-N-butyrate transaminase,GABA-T,L-AIBAT
ec: 2.6.1.19,2.6.1.22
Source :
mol_id organism_scientific organism_common
1 Sus scrofa  (taxid:9823) Pig
Authors : Mascarenhas, R., Juncosa, J.I., Takaya, K., Le, L.V., Moschitto, M.J., Silverman, R.B., Liu, D.
Keywords : Inactivator, GABA Aminotransferase, PLP, TRANSFERASE
Exp. method : X-RAY DIFFRACTION ( 1.95 Å )
Citation :

Design and Mechanism of (S)-3-Amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic Acid, a Highly Potent gamma-Aminobutyric Acid Aminotransferase Inactivator for the Treatment of Addiction.

Juncosa, J.I.,Takaya, K.,Le, H.V.  et al.
(2018)  J. Am. Chem. Soc.  140 : 2151 - 2164

PubMed: 29381352
DOI: 10.1021/jacs.7b10965

Chain : A, B, C, D
UniProt : P80147 (GABT_PIG)
Reaction: EC: Evidence:
Physiological Direction:
2-oxoglutarate + 4-aminobutanoate = L-glutamate + succinate semialdehyde 2.6.1.19 UniProtKB:P50554
left-to-right
(S)-3-amino-2-methylpropanoate + 2-oxoglutarate = 2-methyl-3- oxopropanoate + L-glutamate 2.6.1.22 UniProtKB:P50554
left-to-right