3T6G

Structure of the complex between NSP3 (SHEP1) and p130Cas

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	93
Collection date	2009-09-18
Wavelength(s)	1.075
Spacegroup name	I 41
Unit cell lengths	171.883, 171.883, 78.270
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.555 - 2.500
R-factor	0.1999
Rwork	0.197
R-free	0.26580
Structure solution method	MIR
RMSD bond length	0.008
RMSD bond angle	1.076
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	SHARP
Refinement software	PHENIX ((phenix.refine: 1.6.4_486))

Data quality characteristics

	Overall
Low resolution limit [Å]	29.500
High resolution limit [Å]	2.500
Rmerge	0.071
Number of reflections	39585
Completeness [%]	99.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.8	298	PEG3350 and sodium citrate (pH 7.8), VAPOR DIFFUSION, SITTING DROP, temperature 298K