8W00

Q108K:K40L:T51V:T53S:Y19W:R58W:L117E mutant of hCRBPII bound to synthetic fluorophore TD-1V

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-06
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.97872
Spacegroup name	P 1
Unit cell lengths	29.408, 36.391, 64.273
Unit cell angles	89.84, 89.66, 66.15

Refinement procedure

Resolution	29.550 - 1.230
Rwork	0.173
R-free	0.18500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4qyn
RMSD bond length	0.008
RMSD bond angle	1.274
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.16)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.550	1.270
High resolution limit [Å]	1.230	1.230
Number of reflections	69070	26929
<I/σ(I)>	44.63
Completeness [%]	94.8
Redundancy	1.7
CC(1/2)	0.901	0.915

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	PEG4000, sodium acetate, ammonium aceate