5EAR

Crystal structure of human WDR5 in complex with compound 9d

Summary for 5EAR

• Entry DOI: 10.2210/pdb5ear/pdb
• Related: 5EAL 5EAM 5EAP
• Descriptor: WD repeat-containing protein 5, N-[5-(2,3-dihydro-1-benzofuran-7-yl)-2-(4-methylpiperazin-1-yl)phenyl]-3-methylbenzamide, 1,2-ETHANEDIOL, ... (6 entities in total)
• Functional Keywords: wdr5, compound 9d, structural genomics, structural genomics consortium, sgc, transcription - transcription inhibitor complex, transcription / transcription inhibitor
• Biological source: Homo sapiens (Human)
• Cellular location: Nucleus : P61964
• Total number of polymer chains: 2
• Total formula weight: 70710.21

Authors

DONG, A.,DOMBROVSKI, L.,SMIL, D.,GETLIK, M.,BOLSHAN, Y.,WALKER, J.R.,SENISTERRA, G.,PODA, G.,AL-AWAR, R.,SCHAPIRA, M.,VEDADI, M.,Bountra, C.,Edwards, A.M.,Arrowsmith, C.H.,BROWN, P.J.,WU, H.,Structural Genomics Consortium (SGC) (deposition date: 2015-10-16, release date: 2015-11-04, Last modification date: 2023-09-27)

• Primary citation: Getlik, M.,Smil, D.,Zepeda-Velazquez, C.,Bolshan, Y.,Poda, G.,Wu, H.,Dong, A.,Kuznetsova, E.,Marcellus, R.,Senisterra, G.,Dombrovski, L.,Hajian, T.,Kiyota, T.,Schapira, M.,Arrowsmith, C.H.,Brown, P.J.,Vedadi, M.,Al-Awar, R.; Structure-Based Optimization of a Small Molecule Antagonist of the Interaction Between WD Repeat-Containing Protein 5 (WDR5) and Mixed-Lineage Leukemia 1 (MLL1).; J. Med. Chem., 59:2478-2496, 2016; PubMed: 26958703; DOI: 10.1021/acs.jmedchem.5b01630

Experimental method

X-RAY DIFFRACTION (1.8 Å)