7C04

Crystal structure of human Trap1 with DN203492

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2017-07-19
Detector	ADSC QUANTUM 270
Wavelength(s)	1.00000
Spacegroup name	H 3
Unit cell lengths	110.405, 110.405, 59.445
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	24.210 - 1.700
R-factor	0.1914
Rwork	0.189
R-free	0.23360
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5y3n
RMSD bond length	0.005
RMSD bond angle	0.847
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.730
High resolution limit [Å]	1.700	1.700
Rmerge	0.045	0.363
Number of reflections	29618	29618
<I/σ(I)>	32.1
Completeness [%]	99.4
Redundancy	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	293	0.1M Citrate pH 5.5, 31% PEG 4000