4WZZ

CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM CLOSTRIDIUM PHYTOFERMENTAS (Cphy_0583, TARGET EFI-511148) WITH BOUND L-RHAMNOSE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 31-ID
Synchrotron site	APS
Beamline	31-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2014-11-12
Detector	RAYONIX MX225HE
Wavelength(s)	0.9793
Spacegroup name	P 43 21 2
Unit cell lengths	87.625, 87.625, 83.982
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.666 - 1.700
R-factor	0.1471
Rwork	0.145
R-free	0.18050
Structure solution method	SAD
RMSD bond length	0.009
RMSD bond angle	1.225
Data scaling software	Aimless (0.1.27)
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	87.620	87.620	1.420
High resolution limit [Å]	1.400	7.670	1.400
Rmerge	0.196	0.087	0.455
Rpim	0.037	0.018	0.874
Total number of observations	1855141	11268	87578
Number of reflections	36564
<I/σ(I)>	13.9	46.3	1
Completeness [%]	100.0	100	100
Redundancy	28.6	22.9	27.9
CC(1/2)	0.998	0.992	0.277

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	Protein (51.24 mg/ml, 10 mM HEPES pH 7.5, 5 mM DTT, 10 mM L-RHAMNOSE); Reservoir (0.1 M Sodium Hepes pH 7.5, 1.4 M Sodium Citrate); Cryoprotection (80% Reservoir + 20% Glycerol