7CDL

holo-methanol dehydrogenase (MDH) with Cys131-Cys132 reduced from Methylococcus capsulatus (Bath)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-04-10
Detector	RAYONIX MX300HE
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	128.110, 211.107, 222.554
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 1.850
R-factor	0.15452
Rwork	0.152
R-free	0.19478
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4tqo
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.920
High resolution limit [Å]	1.850	1.850
Number of reflections	508926	50612
<I/σ(I)>	2.42
Completeness [%]	99.8	100
Redundancy	7.4	7.2
CC(1/2)	0.814	0.804

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		291.15	HEPES, PEG600