9DTA

Crystal structure of the WDR domain of WDR91 in complex with DR3448

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	CCD
Collection date	2024-05-01
Detector	RIGAKU SATURN A200
Wavelength(s)	1.54
Spacegroup name	P 1
Unit cell lengths	48.428, 76.316, 77.043
Unit cell angles	119.12, 95.90, 102.57

Refinement procedure

Resolution	28.050 - 2.100
R-factor	0.1889
Rwork	0.188
R-free	0.23279
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.258
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.140
High resolution limit [Å]	2.100	5.700	2.100
Rmerge	0.061	0.024	0.699
Rmeas	0.068	0.027	0.796
Rpim	0.030	0.012	0.375
Total number of observations	252710
Number of reflections	50289	2608	2179
<I/σ(I)>	14.8
Completeness [%]	95.0	98	84.1
Redundancy	5	4.9	4
CC(1/2)	0.999	0.999	0.731

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	10%(w/v) PEG 8K, 20%(v/v) 1,5-pentanediol 0.02 M of each Amino-acid II 0.1 M MOPSO/bis-tris pH 6.5