1W83

p38 Kinase crystal structure in complex with small molecule inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Temperature [K]	100
Spacegroup name	P 21 21 21
Unit cell lengths	45.681, 86.101, 126.079
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.920 - 2.500
R-factor	0.233
Rwork	0.228
R-free	0.32200
Structure solution method	OTHER
RMSD bond length	0.015
RMSD bond angle	1.710
Refinement software	REFMAC (5.2.0003A)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.500
Rmerge	0.150
Number of reflections	17439
<I/σ(I)>	2.6
Completeness [%]	97.7
Redundancy	2.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1