7RRD

IDO1 IN COMPLEX WITH COMPOUND S-1

Summary for 7RRD

• Entry DOI: 10.2210/pdb7rrd/pdb
• Descriptor: Indoleamine 2,3-dioxygenase 1, 3-[4-(1H-benzimidazol-2-yl)phenyl]-N-(4-fluorophenyl)oxetane-3-carboxamide (3 entities in total)
• Functional Keywords: indoleamine dioxygenase, heme, inhibitor, oxidoreductase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 89485.02

Authors

Lesburg, C.A. (deposition date: 2021-08-09, release date: 2022-08-24)

• Primary citation: Li, D.,Sloman, D.,Achab, A.,Zhou, H.,McGowan, M.,White, C.,Gibeau, C.,Zhang, H.,Pu, Q.,Bharathan, I.,Hopkins, B.,Liu, K.,Ferguson, H.,Fradera, X.,Lesburg, C.A.,Martinot, T.A.,Qi, J.,Song, Z.J.,Yin, J.,Song, L.,Wan, B.,D'Addio, S.,Solban, N.,Miller, R.,Zamlynny, B.,Bass, A.,Freeland, E.,Ykoruk, B.,Hilliard, C.,Ferraro, J.,Zhai, J.,Knemayer, I.,Otte, K.,Vincent, S.,Sciammetta, N.,Pasternak, A.,Bennett, D.J.,Han, Y.; Oxetane promise delivered: discovery of long acting IDO1 inhibitors suitable for Q3W oral or parenteral dosing; To Be Published,

Experimental method

X-RAY DIFFRACTION (2.76 Å)