Deposited model

PDB 3R4P|dpdb_6x653beb

Deposited model

Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide

Program
CNX
Model type
Deposited
Purpose
Reference
Authors
Gajiwala, K.S.
Atoms
3,967
Residues
444
Protein chains
2
Unmodeled fraction
1.77%

Evaluations

R-work
0.187
R-free
0.212
Clashscore
4.9

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Heat shock protein HSP 90-alpha226
  • Constructunp residues 9-225

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations