4Z1F

Crystal structure of human Trap1 with PU-H71

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-10-17
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	P 41 21 2
Unit cell lengths	69.223, 69.223, 252.522
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.380 - 2.703
R-factor	0.2251
Rwork	0.222
R-free	0.28010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.917
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall
Low resolution limit [Å]	35.000
High resolution limit [Å]	2.700
Number of reflections	17708
<I/σ(I)>	24.5
Completeness [%]	99.4
Redundancy	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	16% PEG 8K, 100mM calcium acetate, 100mM sodium cacodylate