8GSM

Crystal Structure of VibMO1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-08
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	120.430, 127.780, 146.450
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.140 - 2.880
R-factor	0.236
Rwork	0.234
R-free	0.29310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5eow
RMSD bond length	0.010
RMSD bond angle	1.169
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.18.1_3865)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.980
High resolution limit [Å]	2.880	2.880
Rmerge	0.175	0.768
Rpim	0.094	0.613
Number of reflections	52795	5019
<I/σ(I)>	21.15	3.02
Completeness [%]	99.0	98
Redundancy	9.3	9.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	Sodium bromide , PEG 3350