6RLE

Crystal structure of human monoamine oxidase B in complex with styrylpiperidine analogue 97

Summary for 6RLE

Entry DOI	10.2210/pdb6rle/pdb
Descriptor	Amine oxidase [flavin-containing] B, FLAVIN-ADENINE DINUCLEOTIDE, 4-[2-(4-propan-2-ylphenyl)ethyl]-1-[(~{E})-prop-1-enyl]piperidine, ... (6 entities in total)
Functional Keywords	monoamine oxidase, drug target, neurodegeneration, flavin, isomer, mitochondrial membrane, flavoprotein
Biological source	Homo sapiens (Human)
Total number of polymer chains	2
Total formula weight	120554.64
Authors	Iacovino, L.G.,Knez, D.,Colettis, N.,Sova, M.,Pislar, A.,Higgs, J.,Kamecki, F.,Mangialavori, I.,Dolsak, A.,Zakelj, S.,Trontelj, J.,Kos, J.,Marder, N.M.,Gobec, S.,Binda, C. (deposition date: 2019-05-02, release date: 2020-01-29, Last modification date: 2024-01-24)
Primary citation	Knez, D.,Colettis, N.,Iacovino, L.G.,Sova, M.,Pislar, A.,Konc, J.,Lesnik, S.,Higgs, J.,Kamecki, F.,Mangialavori, I.,Dolsak, A.,Zakelj, S.,Trontelj, J.,Kos, J.,Binda, C.,Marder, M.,Gobec, S. Stereoselective Activity of 1-Propargyl-4-styrylpiperidine-like Analogues That Can Discriminate between Monoamine Oxidase Isoforms A and B. J.Med.Chem., 63:1361-1387, 2020 Cited by PubMed: 31917923 DOI: 10.1021/acs.jmedchem.9b01886 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.3 Å)

Structure validation