9MZY

Crystal structure of human RIPK1 with Compound 22

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-08-05
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	1.0001
Spacegroup name	P 21 21 21
Unit cell lengths	47.307, 95.163, 128.121
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	76.400 - 2.320
R-factor	0.24247
Rwork	0.239
R-free	0.31468
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.580
Data reduction software	autoPROC
Data scaling software	autoPROC ((Version 1.1.7))
Refinement software	REFMAC (5.8.0155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	76.400	2.360
High resolution limit [Å]	2.320	2.320
Number of reflections	25627	1226
<I/σ(I)>	16.5
Completeness [%]	99.6
Redundancy	7.9
CC(1/2)	0.998	0.962

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	20% (w/v) PEG3350; 6 mM Gly3; 0.22 M NH4I