9EW0

Holo IDO with a bound inhibitor

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-15
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	85.050, 92.891, 129.357
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.450 - 1.800
R-factor	0.2509
Rwork	0.249
R-free	0.27830
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	0.950
Data reduction software	autoPROC
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.11.8)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.500	1.910
High resolution limit [Å]	1.800	1.800
Rmeas	0.200	6.100
Number of reflections	95350	14907
<I/σ(I)>	8.4	0.39
Completeness [%]	99.5
Redundancy	6.7
CC(1/2)	0.990	0.134

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	10% w/v PEG 4000, 20% v/v glycerol, 0.1 M MOPS/HEPES-Na pH 7.5