Ensemble refinement model

PDB 6FEX|dpdb_8wn1751q

Ensemble refinement model

DDR1, 2-[4-bromo-2-oxo-1'-(1H-pyrazolo[4,3-b]pyridine-5-carbonyl)spiro[indole-3,4'-piperidine]-1-yl]-N-(2,2,2-trifluoroethyl)acetamide, 1.291A, P212121, Rfree=17.4%

Program: PHENIX phenix.ensemble_refinement
Model type: Ensemble
Purpose: Refinement
Atoms: 172,022

Residues: 289
Protein chains: 1
Alternate-location fraction: 0%
Ligands: CL, D6Z, IOD, MES

Evaluations

R-work

0.210

R-free

0.245

Clashscore

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Macromolecules

The same in every model of this entry.

Entity 1
Molecule	Chains	Length	Organism	UniProt	Details
Epithelial discoidin domain-containing receptor 1		321	Homo sapiens9606	Q08345SIFTS · 2026_03	Constructtyrosine kinase domain, residues 593-913 MutationsDEL(730-735) 2-[4-bromo-2-oxo-1'-(1H-pyrazolo[4,3-b]pyridine-5-carbonyl)spiro[indole-3,4'-piperidine]-1-yl]-N-(2,2,2-trifluoroethyl)acetamide

Data

L0 Raw

L1 Processed

L2 Models

L3 Evaluations