5U9I

Crystal structure of the FKBP domain of human aryl hydrocarbon receptor-interacting protein-like 1 (AIPL1) complexed with S-farnesyl-L-cysteine methyl ester

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	2016-09-22
Detector	RDI CMOS_8M
Wavelength(s)	1
Spacegroup name	C 2 2 21
Unit cell lengths	54.970, 66.180, 106.960
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.286 - 2.300
R-factor	0.2362
Rwork	0.235
R-free	0.26630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5u9a
RMSD bond length	0.011
RMSD bond angle	1.191
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.290	2.420
High resolution limit [Å]	2.300	2.300
Rmerge	0.115	1.060
Number of reflections	8993
<I/σ(I)>	15.6	3.2
Completeness [%]	99.9	99.9
Redundancy	13.3	13.1
CC(1/2)	0.999	0.970

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