5BOT

X-RAY Co-structure of MMP-13 with ethyl 5-carbamoyl-1H-indole-2-carboxylate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E DW
Temperature [K]	63
Detector technology	CCD
Collection date	2007-04-30
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.6
Spacegroup name	C 1 2 1
Unit cell lengths	134.641, 35.953, 95.824
Unit cell angles	90.00, 130.78, 90.00

Refinement procedure

Resolution	50.977 - 1.850
R-factor	0.1726
R-free	0.22860
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.977	1.916
High resolution limit [Å]	1.850	1.850
Rmerge	0.081
Number of reflections	28513
<I/σ(I)>	4.8
Completeness [%]	94.4
Redundancy	7.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	14-28% PEG 4000 0.6M Ammonium Formate 0. M Tris pH 8