8JUD

Crystal structure of human MMP-7 in complex with inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-10-14
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.00000
Spacegroup name	I 4
Unit cell lengths	77.350, 77.350, 62.370
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	54.690 - 1.500
R-factor	0.23259
Rwork	0.231
R-free	0.25976
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.019
RMSD bond angle	1.938
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	54.690	1.590
High resolution limit [Å]	1.500	1.500
Number of reflections	27517	4453
<I/σ(I)>	3.19	0.99
Completeness [%]	93.3	95.1
Redundancy	10.7	10.5
CC(1/2)	0.742	0.423

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7	293	10% w/v Polyethylene glycol 8000, 100mM Tris pH7.0, 200mM Magnesium chloride