5HMM

Crystal Structure of T5 D15 Protein Co-crystallized with Metal Ions

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-03-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97836
Spacegroup name	P 1
Unit cell lengths	46.831, 58.591, 59.729
Unit cell angles	66.88, 79.40, 73.78

Refinement procedure

Resolution	38.350 - 1.500
R-factor	0.1501
Rwork	0.148
R-free	0.19670
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1exn
RMSD bond length	0.011
RMSD bond angle	1.329
Data reduction software	iMOSFLM
Data scaling software	SCALA (3.3.21)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	54.735	38.730	1.580
High resolution limit [Å]	1.500	4.740	1.500
Rmerge		0.039	0.322
Rmeas	0.093
Rpim	0.042	0.018	0.296
Total number of observations	313085	15866	25799
Number of reflections	83343
<I/σ(I)>	10.5	38.1	2.5
Completeness [%]	93.1	97.3	90.4
Redundancy	3.8	5.7	2.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	280	PACT H2: 0.2M Na bromide, 0.1M Bis Tris propane pH 8.5, 20% PEG 3350