5BOY

X-RAY Co-structure of MMP-13 with ethyl 5-(1-methyl-1H-imidazol-5-yl)-1H-indole-2-Carboxylate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	290
Detector technology	CCD
Collection date	2007-12-19
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.98
Spacegroup name	C 1 2 1
Unit cell lengths	135.079, 36.051, 95.908
Unit cell angles	90.00, 131.26, 90.00

Refinement procedure

Resolution	67.420 - 2.030
Rwork	0.160
R-free	0.19000
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	67.420	2.090
High resolution limit [Å]	2.030	2.030
Rmerge	0.079	0.161
Number of reflections	22828
<I/σ(I)>	13.6	7.27
Completeness [%]	99.6	63
Redundancy	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	10% PEG 4000, 1M Ammonimum Formate, 100 mM Tris pH 8