Rerefined model

PDB 5J87|dpdb_d4gnw415

Rerefined model

Discovery of N-(3-(5-((3-acrylamido-4-(morpholine-4-carbonyl)phenyl)amino)-1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-2-methylphenyl)-4-(tert-butyl)benzamide (CHMFL-BTK-01) as a Highly Selective Irreversible BTK Kinase Inhibitor

Program
PHENIX 2.0_5824
Model type
Multiconformer
Purpose
Refinement
Atoms
9,816
Residues
1,061
Protein chains
4
Alternate-location fraction
0.66%
Ligand
N42

Evaluations

R-work
0.234
R-free
0.280
Clashscore
25.2

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase BTK274
  • ConstructUNP RESIDUES 385-658

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations