4Y6I

Crystal structure of E.coli CutA1 E61V/C16A/C39A/C79A mutation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B2
Synchrotron site	SPring-8
Beamline	BL26B2
Temperature [K]	100
Detector technology	CCD
Collection date	2010-05-21
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.0000
Spacegroup name	P 43
Unit cell lengths	127.720, 127.720, 38.201
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.180 - 1.700
R-factor	0.172
Rwork	0.171
R-free	0.19970
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.096
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall
Low resolution limit [Å]	35.180
High resolution limit [Å]	1.700
Number of reflections	64900
<I/σ(I)>	10.9
Completeness [%]	99.6
Redundancy	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1M HEPES-Na pH7.5 , 1.4M tri-Sodium Citrate dihydrate