2DVM

NAD complex structure of PH1275 protein from Pyrococcus horikoshii

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2005-09-13
Detector	RIGAKU RAXIS V
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	101.856, 74.294, 141.157
Unit cell angles	90.00, 100.37, 90.00

Refinement procedure

Resolution	29.840 - 1.600
R-factor	0.191
Rwork	0.191
R-free	0.20700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ww8
RMSD bond length	0.006
RMSD bond angle	1.300
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.660
High resolution limit [Å]	1.600	1.600
Rmerge	0.030
Number of reflections	272545
<I/σ(I)>	12.4
Completeness [%]	99.6	99.6
Redundancy	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	6.4	295	PEG 4000, MES, pH 6.4, microbatch, temperature 295K