6T1L

Crystal structure of MLLT1 (ENL) YEATS domain in complexed with piperazine-urea derivative 3

Summary for 6T1L

Entry DOI	10.2210/pdb6t1l/pdb
Descriptor	Protein ENL, 1,2-ETHANEDIOL, ~{N}-[[4-(diethylaminomethyl)phenyl]methyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide, ... (4 entities in total)
Functional Keywords	transcription, yeats domain, enl, mllt1, chemical probe, inhibitor, structural genomics, structural genomics consortium, sgc
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	19228.19
Authors	Chaikuad, A.,Heidenreich, D.,Arrowsmith, C.H.,Edwards, A.M.,Bountra, C.,Fedorov, O.,Knapp, S.,Structural Genomics Consortium (SGC) (deposition date: 2019-10-04, release date: 2019-11-06, Last modification date: 2024-01-24)
Primary citation	Ni, X.,Heidenreich, D.,Christott, T.,Bennett, J.,Moustakim, M.,Brennan, P.E.,Fedorov, O.,Knapp, S.,Chaikuad, A. Structural Insights into Interaction Mechanisms of Alternative Piperazine-urea YEATS Domain Binders in MLLT1. Acs Med.Chem.Lett., 10:1661-1666, 2019 Cited by PubMed: 31857843 DOI: 10.1021/acsmedchemlett.9b00460 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation