Deposited model

PDB 5J87|dpdb_d4gnw415

Deposited 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 1.8.4_1496
Model type
Deposited
Purpose
Reference
Authors
Yun, C.H., Zhang, S.
Atoms
9,721
Residues
1,061
Protein chains
4
Unmodeled fraction
3.19%
Ligand
N42

Evaluations

R-work
0.216
R-free
0.248
Clashscore
30.4

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