4ILW

Complex of matrix metalloproteinase-10 catalytic domain (MMP-10cd) with tissue inhibitor of metalloproteinases-2 (TIMP-2)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2012-08-07
Detector	ADSC QUANTUM 315
Spacegroup name	P 1
Unit cell lengths	37.687, 56.934, 82.592
Unit cell angles	76.14, 79.84, 71.25

Refinement procedure

Resolution	40.580 - 2.103
R-factor	0.21873
Rwork	0.216
R-free	0.26305
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3v96 1br9
RMSD bond length	0.014
RMSD bond angle	1.667
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.140
High resolution limit [Å]	2.100	2.100
Rmerge	0.073	0.415
Number of reflections	35606
<I/σ(I)>	11.2	2.2
Completeness [%]	97.7	94
Redundancy	3.1	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	298	0.1 M HEPES pH 7.5, 25 % (w/v) PEG 2000 MME, VAPOR DIFFUSION, temperature 298K