1GUS

MopII from Clostridium pasteurianum (apo1)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	100
Collection date	2001-05-15
Detector	RIGAKU R-AXIS IV
Spacegroup name	C 1 2 1
Unit cell lengths	79.080, 82.400, 56.820
Unit cell angles	90.00, 93.23, 90.00

Refinement procedure

Resolution	23.770 - 1.800
R-factor	0.181
Rwork	0.179
R-free	0.21700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1gug
RMSD bond length	0.019
RMSD bond angle	2.000 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	REFMAC (5.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	1.840
High resolution limit [Å]	1.800	1.800
Rmerge	0.041	0.280
Total number of observations	124432 *
Number of reflections	33112
<I/σ(I)>	16.8	2.6
Completeness [%]	97.6	93.9
Redundancy	1.9	1.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7.5 *	293 *	Harrison, J.A., (2001) Acta Crystallogr., D57, 1715. *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	30 (mg/ml)
2	1	reservoir		2 (M)
3	1	reservoir	PEG6000	10 (%(w/v))