1D8F

CRYSTAL STRUCTURE OF MMP3 COMPLEXED WITH A PIPERAZINE BASED INHIBITOR.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU300
Temperature [K]	173
Detector technology	IMAGE PLATE
Collection date	1996-02-27
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	38.270, 78.540, 106.580
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.400
Rwork	0.294
R-free	0.25200
RMSD bond length	0.009
RMSD bond angle	1.600
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	X-PLOR
Refinement software	X-PLOR (3.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.380
High resolution limit [Å]	2.300	2.300
Rmerge	0.132	0.239
Number of reflections	14271
<I/σ(I)>	25.8
Completeness [%]	97.7	82.8
Redundancy	5.4	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	8.5	298	PEG 6000, sodium chloride, magnesium chloride, Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K