5Y3N

Structure of TRAP1 complexed with DN401

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	2015-07-24
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9796
Spacegroup name	P 41 21 2
Unit cell lengths	69.410, 69.410, 252.159
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.705 - 2.400
R-factor	0.2105
Rwork	0.208
R-free	0.25730
RMSD bond length	0.004
RMSD bond angle	0.782
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.440
High resolution limit [Å]	2.400	2.400
Rmerge	0.070
Rpim	0.030
Number of reflections	25006
<I/σ(I)>	40
Completeness [%]	99.1
Redundancy	6.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	PEG 8000, sodium cacodylate, calcium acetate