3JTS

GY9-Mamu-A*02-hb2m

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2008-02-10
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5478
Spacegroup name	C 1 2 1
Unit cell lengths	123.960, 110.331, 100.095
Unit cell angles	90.00, 114.32, 90.00

Refinement procedure

Resolution	38.695 - 2.801
R-factor	0.1994
Rwork	0.197
R-free	0.24840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1zvs
RMSD bond length	0.005
RMSD bond angle	0.848
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	PHENIX ((phenix.refine))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.900
High resolution limit [Å]	2.800	2.800
Rmerge	0.157	0.589
Number of reflections	30177
<I/σ(I)>	17.9	4.2
Completeness [%]	100.0	100
Redundancy	7.3	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	291	(i) 0.1M Tris-HCl pH 5.5, 0.12M ammonium sulfate, 38% polyethene glycol monomethyl ether 20000; (ii) 0.1M MES pH 6.5, 0.32M ammonium sulfate, 38% polyethene glycol monomethyl ether 20 000, VAPOR DIFFUSION, HANGING DROP, temperature 291K