1WN2

Crystal structure of project ID PH1539 from Pyrococcus horikoshii OT3

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	2003-10-19
Detector	RIGAKU RAXIS V
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	49.670, 49.670, 85.791
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.120 - 1.200
R-factor	0.193
Rwork	0.193
R-free	0.21500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1rlk
RMSD bond length	0.006
RMSD bond angle	1.500
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.240
High resolution limit [Å]	1.200	1.200
Rmerge	0.055	0.336
Number of reflections	34325
<I/σ(I)>	15.4	4.7
Completeness [%]	100.0	100
Redundancy	8.98	8.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Microbach	9.2	291	PEG 20k 16.5w/v(%), Ches 0.1M, pH 9.2, Microbach, temperature 291K