2WSQ

MonoTIM mutant RMM0-1, dimeric form.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL7-1
Synchrotron site	SSRL
Beamline	BL7-1
Temperature [K]	100
Detector technology	CCD
Collection date	2006-05-16
Detector	ADSC CCD
Spacegroup name	P 21 21 21
Unit cell lengths	90.882, 94.082, 108.885
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	71.250 - 2.100
R-factor	0.20813
Rwork	0.204
R-free	0.24377
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1tri
RMSD bond length	0.020
RMSD bond angle	1.586
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	CNS
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.140	2.150
High resolution limit [Å]	2.100	2.100
Rmerge	0.060	0.360
Number of reflections	53956
<I/σ(I)>	9.1	2
Completeness [%]	98.2	98.5
Redundancy	4.3	4.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.2	303	100 MM MES BUFFER PH 6.2, 180 MM LI2SO4, 26 PERCENT PEG 6000, 5 MM DITHIOTHREITOL, 1 MM EDTA AND 1 MM NAN3, AT 30 DEGREES CELSIUS.