6FK1

Cyclophilin A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-18
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.98005
Spacegroup name	P 32 2 1
Unit cell lengths	61.717, 61.717, 93.130
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.357 - 1.299
R-factor	0.1636
Rwork	0.163
R-free	0.18110
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2cpl
RMSD bond length	0.014
RMSD bond angle	1.372
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.360	1.346
High resolution limit [Å]	1.299	1.299
Rmerge	0.043
Rmeas	0.045
Rpim	0.014	0.662
Number of reflections	51157	5010
<I/σ(I)>	24.47	0.79
Completeness [%]	99.9	98.89
Redundancy	10.9	10.7
CC(1/2)	1.000	0.392

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	3.5M Sodium formate