4PQQ

The crystal structure of discoidin domain from muskelin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-03-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97951
Spacegroup name	H 3
Unit cell lengths	98.303, 98.303, 57.317
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.161 - 1.550
R-factor	0.1546
Rwork	0.153
R-free	0.17620
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	1.142
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.610
High resolution limit [Å]	1.550	1.550
Rmerge	0.069	0.184
<I/σ(I)>	24.395	5.69
Completeness [%]	98.2	90.8
Redundancy	4.1	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	295	25% PEG 1500, 0.1M SPG(succinate-Phosphate-glycine), pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K
1	VAPOR DIFFUSION, HANGING DROP	5.5	295	25% PEG 1500, 0.1M SPG(succinate-Phosphate-glycine), pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K