5C1B

p97-delta709-728 in complex with a UFD1-SHP peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-07-07
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97625
Spacegroup name	P 21 21 21
Unit cell lengths	140.715, 180.664, 254.958
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.136 - 3.080
R-factor	0.1997
Rwork	0.198
R-free	0.24020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3cf3
RMSD bond length	0.003
RMSD bond angle	0.730
Data reduction software	XDS
Data scaling software	Aimless (0.1.27)
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	49.140	49.140	3.130
High resolution limit [Å]	3.080	16.870	3.080
Rmerge	0.119	0.042	2.582
Rpim	0.037	0.013	0.813
Total number of observations	1326505	8170	64372
Number of reflections	120596
<I/σ(I)>	12.8	40.6	1.1
Completeness [%]	100.0	96.3	99.9
Redundancy	11	9.9	10.9
CC(1/2)	0.999	0.999	0.527

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	6.5-7% PEG 4000, 0.4-0.6 M potassium acetate, 0.1 M MES pH 5.75