4JE6

Crystal structure of a human-like mitochondrial peptide deformylase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM30A
Synchrotron site	ESRF
Beamline	BM30A
Temperature [K]	100
Spacegroup name	P 21 21 21
Unit cell lengths	51.450, 73.980, 109.390
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.960 - 2.000
R-factor	0.1578
Rwork	0.156
R-free	0.18543
Structure solution method	rigid body
Starting model (for MR)	1zxz
RMSD bond length	0.014
RMSD bond angle	1.354
Data reduction software	XDS
Data scaling software	XDS
Phasing software	REFMAC (5.2.0019)
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.040
High resolution limit [Å]	1.940	1.940
Number of reflections	30924
<I/σ(I)>	17.52	8.22
Completeness [%]	97.6	85.6
Redundancy	5.3	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	5-15% PEG 5000 MME, 100mM MES, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K