5ECK

Crystal Structure of FIN219-FIP1 complex with JA, Ile and ATP

Experimental procedure

Experimental method	LAUE
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL13C1
Synchrotron site	NSRRC
Beamline	BL13C1
Temperature [K]	100
Detector technology	CCD
Collection date	2012-11-08
Detector	RAYONIX MX-300
Wavelength(s)	0.9762-0.97622
Spacegroup name	P 1
Unit cell lengths	53.857, 53.853, 196.399
Unit cell angles	92.33, 97.16, 113.48

Refinement procedure

Resolution	24.238 - 1.540
R-factor	0.1636
Rwork	0.162
R-free	0.17500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4epl
RMSD bond length	0.012
RMSD bond angle	1.590
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.600
High resolution limit [Å]	1.540	3.320	1.540
Rmerge	0.038	0.021	0.332
Total number of observations	563444
Number of reflections	294617
<I/σ(I)>	8.3
Completeness [%]	95.8	95	93.1
Redundancy	2	2	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	297	0.2 M sodium acetate trihydrate, 0.1 M Tris-HCl, 30%(w/v) PEG 3000