2JHR

Crystal structure of myosin-2 motor domain in complex with ADP- metavanadate and pentabromopseudilin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	CCD
Collection date	2007-04-19
Detector	Bruker Platinum 135
Wavelength(s)	1.54
Spacegroup name	C 2 2 21
Unit cell lengths	89.758, 150.464, 154.550
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.800
R-factor	0.217
Rwork	0.217
R-free	0.26500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yv3
RMSD bond length	0.009
RMSD bond angle	1.400
Data reduction software	PROTEUM2
Data scaling software	PROTEUM2
Phasing software	AMoRE
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.900
High resolution limit [Å]	2.800	2.800
Rmerge	0.090	0.400
Number of reflections	25708
<I/σ(I)>	10.9	2.4
Completeness [%]	98.2	95.5
Redundancy	5.2	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.4		50 MM HEPES PH 7.4, 140 MM NACL, 11% W/V PEG8000, 2% (V/V) MPD, 5 MM MGCL2, 5 MM DTT, 1 MM EGTA.