Deposited model

PDB 6YPP|dpdb_6ww8rrk6

Deposited model

Crystal structure of the cAMP-dependent protein kinase A cocrystallized with PKI (5-24). Soaking of aminofasudil and displacing it with the fragment isoquinoline.

Program
PHENIX 1.17.1_3660
Model type
Deposited
Purpose
Reference
Authors
Oebbeke, M., Gerber, H.-D., Heine, A., Klebe, G.
Atoms
3,027
Residues
353
Protein chains
2
Unmodeled fraction
5.36%

Evaluations

R-work
0.177
R-free
0.203
Clashscore
1.1

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
cAMP-dependent protein kinase catalytic subunit alpha353—
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
cAMP-dependent protein kinase inhibitor alpha20—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations