7XEB

Collagenase from Grimontia (Vibrio) hollisae 1706B complexed with Gly-Pro-Hyp

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-12
Detector	DECTRIS EIGER R 4M
Wavelength(s)	1.0000
Spacegroup name	P 1 21 1
Unit cell lengths	72.972, 75.549, 130.551
Unit cell angles	90.00, 103.06, 90.00

Refinement procedure

Resolution	45.410 - 2.390
R-factor	0.2086
Rwork	0.206
R-free	0.25480
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7wss
RMSD bond length	0.008
RMSD bond angle	0.946
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.540
High resolution limit [Å]	2.390	2.390
Rmerge	0.093	0.727
Rmeas	0.109	0.844
Number of reflections	54059	8681
<I/σ(I)>	12.38	2.34
Completeness [%]	98.5	98.3
Redundancy	3.71	3.84
CC(1/2)	0.997	0.787

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	0.1M Cacodylic acid sodium salt, 0.2M Calcium acetate, 18%(w/v) PEG 8000