5F3I
Crystal structure of human KDM4A in complex with compound 54j
Summary for 5F3I
Entry DOI | 10.2210/pdb5f3i/pdb |
Descriptor | Lysine-specific demethylase 4A, ZINC ION, 8-[4-[2-[4-[3,5-bis(chloranyl)phenyl]piperidin-1-yl]ethyl]pyrazol-1-yl]-3~{H}-pyrido[3,4-d]pyrimidin-4-one, ... (7 entities in total) |
Functional Keywords | epigenetics, demethylase, inhibitor, oxidoreductase |
Biological source | Homo sapiens (Human) |
Cellular location | Nucleus : O75164 |
Total number of polymer chains | 4 |
Total formula weight | 170259.28 |
Authors | Le Bihan, Y.-V.,Dempster, S.,Westwood, I.M.,van Montfort, R.L.M. (deposition date: 2015-12-02, release date: 2016-01-20, Last modification date: 2024-01-10) |
Primary citation | Bavetsias, V.,Lanigan, R.M.,Ruda, G.F.,Atrash, B.,McLaughlin, M.G.,Tumber, A.,Mok, N.Y.,Le Bihan, Y.V.,Dempster, S.,Boxall, K.J.,Jeganathan, F.,Hatch, S.B.,Savitsky, P.,Velupillai, S.,Krojer, T.,England, K.S.,Sejberg, J.,Thai, C.,Donovan, A.,Pal, A.,Scozzafava, G.,Bennett, J.M.,Kawamura, A.,Johansson, C.,Szykowska, A.,Gileadi, C.,Burgess-Brown, N.A.,von Delft, F.,Oppermann, U.,Walters, Z.,Shipley, J.,Raynaud, F.I.,Westaway, S.M.,Prinjha, R.K.,Fedorov, O.,Burke, R.,Schofield, C.J.,Westwood, I.M.,Bountra, C.,Muller, S.,van Montfort, R.L.,Brennan, P.E.,Blagg, J. 8-Substituted Pyrido[3,4-d]pyrimidin-4(3H)-one Derivatives As Potent, Cell Permeable, KDM4 (JMJD2) and KDM5 (JARID1) Histone Lysine Demethylase Inhibitors. J.Med.Chem., 59:1388-1409, 2016 Cited by PubMed: 26741168DOI: 10.1021/acs.jmedchem.5b01635 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.24 Å) |
Structure validation
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