5U9K

Crystal structure of V71F mutant of the FKBP domain of human aryl hydrocarbon receptor-interacting protein-like 1 (AIPL1)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2016-11-09
Detector	RDI CMOS_8M
Wavelength(s)	1
Spacegroup name	C 2 2 21
Unit cell lengths	51.790, 65.070, 106.180
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.520 - 2.700
R-factor	0.20334
Rwork	0.201
R-free	0.25741
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5u9a
RMSD bond length	0.012
RMSD bond angle	1.598
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.522	2.850
High resolution limit [Å]	2.700	2.700
Rmerge	0.064	0.787
Number of reflections	5195	732
<I/σ(I)>	23.3	3.2
Completeness [%]	99.9	99.7
Redundancy	12.4	11.6
CC(1/2)	1.000	0.966

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	100 mM Na-Citrate 20% (W/V) PEG 4000 20% (V/V) 2-Propanol