Database of articles cited by EMDB/PDB/SASBDB data

Keywords
Structure methods	All X-ray diffraction NMR electron microscopy small angle scattering neutron diffraction fiber diffraction powder diffraction infrared spectroscopy EPR fluorescence transfer theoretical model Hybrid
Author
Journal
IF	>30 >20 >10 >5 all

Title	Fragment-based screening by X-ray crystallography, MS and isothermal titration calorimetry to identify PNMT (phenylethanolamine N-methyltransferase) inhibitors.
Journal, issue, pages	Biochem. J., Vol. 431, Page 51-61, Year 2010
Publish date	Nov 16, 2009 (structure data deposition date)
Authors	Drinkwater, N. / Vu, H. / Lovell, K.M. / Criscione, K.R. / Collins, B.M. / Prisinzano, T.E. / Poulsen, S.A. / McLeish, M.J. / Grunewald, G.L. / Martin, J.L.
External links	Biochem. J. / PubMed:20642456
Methods	X-ray diffraction
Resolution	2.005 - 2.6 Å
Structure data	PDB-3kpj: Crystal Structure of hPNMT in Complex AdoHcy and Bound Phosphate Method: X-RAY DIFFRACTION / Resolution: 2.5 Å PDB-3kpu: Crystal Structure of hPNMT in Complex AdoHcy and 4-quinolinol Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kpv: Crystal Structure of hPNMT in Complex AdoHcy and Adenine Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kpw: Crystal Structure of hPNMT in Complex AdoHcy and 1-Aminoisoquinoline Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kpy: Crystal Structure of hPNMT in Complex AdoHcy and 6-Chlorooxindole Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kqm: Crystal Structure of hPNMT in Complex AdoHcy and 4-Bromo-1H-imidazole Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kqo: Crystal Structure of hPNMT in Complex AdoHcy and 6-Chloropurine Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kqp: Crystal Structure of hPNMT in Complex AdoHcy and 6-Aminoquinoline Method: X-RAY DIFFRACTION / Resolution: 2.4 Å PDB-3kqq: Crystal Structure of hPNMT in Complex AdoHcy and 2-Hydroxynicotinic acid Method: X-RAY DIFFRACTION / Resolution: 2.5 Å PDB-3kqs: Crystal Structure of hPNMT in Complex AdoHcy and 2-Aminobenzimidazole Method: X-RAY DIFFRACTION / Resolution: 2.005 Å PDB-3kqt: Crystal Structure of hPNMT in Complex AdoHcy and 2-Amino-1-methylbenzimidazole Method: X-RAY DIFFRACTION / Resolution: 2.399 Å PDB-3kqv: Crystal Structure of hPNMT in Complex AdoHcy and Formanilide Method: X-RAY DIFFRACTION / Resolution: 2.3 Å PDB-3kqw: Crystal Structure of hPNMT in Complex AdoHcy and 5-Chlorobenzimidazole Method: X-RAY DIFFRACTION / Resolution: 2.486 Å PDB-3kqy: Crystal Structure of hPNMT in Complex AdoHcy and 2-amino-1H-benzo[d]imidazol-7-ol Method: X-RAY DIFFRACTION / Resolution: 2.2 Å PDB-3kr0: Crystal Structure of hPNMT in Complex AdoHcy and 2-amino-1H-benzo[d]imidazol-6-ol Method: X-RAY DIFFRACTION / Resolution: 2.6 Å PDB-3kr1: Crystal Structure of hPNMT in Complex AdoHcy and 5-chloro-1H-benzo[d]imidazol-2-amine Method: X-RAY DIFFRACTION / Resolution: 2.3 Å PDB-3kr2: Crystal Structure of hPNMT in Complex AdoHcy and 5-fluoro-1H-benzo[d]imidazol-2-amine Method: X-RAY DIFFRACTION / Resolution: 2.3 Å
Chemicals	ChemComp-SAH: S-ADENOSYL-L-HOMOCYSTEINE / S-Adenosyl-L-homocysteine ChemComp-PO4: PHOSPHATE ION / Phosphate ChemComp-HOH: WATER / Water ChemComp-ES1: quinolin-4-ol / 4-Quinolone ChemComp-ADE: ADENINE / Adenine ChemComp-1SQ: ISOQUINOLIN-1-AMINE ChemComp-ES2: 6-chloro-1,3-dihydro-2H-indol-2-one ChemComp-ES3: 4-bromo-1H-imidazole ChemComp-ES4: 6-chloro-9H-purine ChemComp-ES5: quinolin-6-amine ChemComp-ES6: 2-oxo-1,2-dihydropyridine-3-carboxylic acid ChemComp-AX7: 1H-benzimidazol-2-amine ChemComp-ES7: 1-methyl-1H-benzimidazol-2-amine ChemComp-FAN: FORMANILIDE / Formanilide ChemComp-ES9: 5-chloro-1H-benzimidazole ChemComp-ES0: 2-amino-1H-benzimidazol-7-ol ChemComp-172: 2-AMINO-5-HYDROXY-BENZIMIDAZOLE ChemComp-VGD: 6-chloro-1H-benzimidazol-2-amine ChemComp-ET2: 6-fluoro-1H-benzimidazol-2-amine
Source	homo sapiens (human)
Keywords	TRANSFERASE / methyltransferase / fragment screening / Catecholamine biosynthesis / S-adenosyl-L-methionine