7X68

CYS179 and CYS504 of CRMP2 were covalently binded by a Sesquiterpene lactone

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-1
Synchrotron site	ESRF
Beamline	ID14-1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-09-28
Detector	ADSC QUANTUM 210
Wavelength(s)	0.97677
Spacegroup name	I 41 2 2
Unit cell lengths	113.649, 113.649, 196.585
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.027 - 1.800
Rwork	0.176
R-free	0.21350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2gse
RMSD bond length	0.010
RMSD bond angle	1.673
Data reduction software	HKL-2000
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	98.420	1.840
High resolution limit [Å]	1.800	1.800
Rmerge	0.031	0.436
Number of reflections	59704	6750
<I/σ(I)>	23.75
Completeness [%]	100.0
Redundancy	1
CC(1/2)		0.763

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 Sodium chloride, 0.1 M Bis-tris Ph5.5; 25% PEG 3350