6WPE
HUMAN IDO1 IN COMPLEX WITH COMPOUND 4
Summary for 6WPE
Entry DOI | 10.2210/pdb6wpe/pdb |
Descriptor | Indoleamine 2,3-dioxygenase 1, 4-chloro-N-{[1-(3-chlorobenzene-1-carbonyl)-1,2,3,4-tetrahydroquinolin-6-yl]methyl}benzamide (3 entities in total) |
Functional Keywords | indoleamine dioxygenase, heme, inhibitor, oxidoreductase, oxidoreductase-oxidoreductase inhibitor complex |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 2 |
Total formula weight | 89588.87 |
Authors | Lesburg, C.A.,Lammens, A. (deposition date: 2020-04-27, release date: 2021-03-10, Last modification date: 2024-04-03) |
Primary citation | Li, D.,Deng, Y.,Achab, A.,Bharathan, I.,Hopkins, B.A.,Yu, W.,Zhang, H.,Sanyal, S.,Pu, Q.,Zhou, H.,Liu, K.,Lim, J.,Fradera, X.,Lesburg, C.A.,Lammens, A.,Martinot, T.A.,Cohen, R.D.,Doty, A.C.,Ferguson, H.,Nickbarg, E.B.,Cheng, M.,Spacciapoli, P.,Geda, P.,Song, X.,Smotrov, N.,Abeywickrema, P.,Andrews, C.,Chamberlin, C.,Mabrouk, O.,Curran, P.,Richards, M.,Saradjian, P.,Miller, J.R.,Knemeyer, I.,Otte, K.M.,Vincent, S.,Sciammetta, N.,Pasternak, A.,Bennett, D.J.,Han, Y. Carbamate and N -Pyrimidine Mitigate Amide Hydrolysis: Structure-Based Drug Design of Tetrahydroquinoline IDO1 Inhibitors. Acs Med.Chem.Lett., 12:389-396, 2021 Cited by PubMed: 33738066DOI: 10.1021/acsmedchemlett.0c00525 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.43 Å) |
Structure validation
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