8JUG

Crystal structure of human MMP-7 in complex with inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-08-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00004
Spacegroup name	I 4
Unit cell lengths	76.060, 76.060, 61.890
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.050 - 1.300
R-factor	0.22208
Rwork	0.221
R-free	0.23789
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.979
Data reduction software	iMOSFLM
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.050	1.370
High resolution limit [Å]	1.300	1.300
Number of reflections	42891	6269
<I/σ(I)>	9.2	1.4
Completeness [%]	99.8
Redundancy	12.3
CC(1/2)	0.998	0.583

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	9	293	10% w/v Polyethylene glycol 20000, 2% v/v 1,4-Dioxane, 100mM BICINE pH9.0