6Z5F

CRYSTAL STRUCTURE OF RAT PEROXISOMAL MULTIFUNCTIONAL ENZYME TYPE-1 (RPMFE1) COMPLEXED WITH 3-KETODECANOYL-COA AND OXIDISED NICOTINAMIDE ADENINE DINUCLEOTIDE

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-02-28
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.9762
Spacegroup name	P 21 21 21
Unit cell lengths	65.155, 125.977, 223.527
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	62.630 - 2.250
Rwork	0.209
R-free	0.24640
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5omo
RMSD bond length	0.005
RMSD bond angle	1.205
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.630	2.290
High resolution limit [Å]	2.250	2.250
Rmerge	0.099	1.388
Rpim	0.042	0.587
Number of reflections	88285	4441
<I/σ(I)>	8.4	1.2
Completeness [%]	100.0
Redundancy	6.45
CC(1/2)	0.997	0.671

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	295	100mM MES, pH 6; 15%w/v PEG 4000; 150.91mM ammonium sulfate