6FYC

The crystal structure of EncM L144M mutant complex with dioxygen under 15 bars O2 pressure

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-08-22
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.99997
Spacegroup name	P 21 2 21
Unit cell lengths	79.794, 87.358, 128.287
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.679 - 2.000
R-factor	0.2415
Rwork	0.240
R-free	0.27220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4xlo
RMSD bond length	0.009
RMSD bond angle	1.113
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((1.11rc1_2513: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.680	2.110
High resolution limit [Å]	2.000	2.000
Rmerge	0.060	0.540
Number of reflections	61351
<I/σ(I)>	21.4
Completeness [%]	100.0
Redundancy	13.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.1M HEPES-Na, 0.2M Calcium Acetate, 20% - 30% PEG 3350, pH 7.5