5KLZ

Human Histidine Triad Nucleotide Binding Protein 1 (hHint1) AMP catalytic product complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-12-15
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	45.831, 75.921, 80.794
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.960 - 1.500
R-factor	0.1652
Rwork	0.164
R-free	0.18390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1kpa
RMSD bond length	0.005
RMSD bond angle	0.891
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	80.794	45.831	1.505
High resolution limit [Å]	1.500	6.954	1.500
Rmerge		0.055	0.354
Number of reflections	45786
<I/σ(I)>	14.5
Completeness [%]	99.7	99.8	98.8
Redundancy	6.1	5.4	6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.7	293	100 mM MES, 37% PEG 8000,