5YCV

X-Ray Structure of Enoyl-Acyl Carrier Protein Reductase from Bacillus Anthracis (Apo form)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2016-10-15
Detector	ADSC QUANTUM 210r
Wavelength(s)	1.0
Spacegroup name	P 31
Unit cell lengths	106.905, 106.905, 75.914
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.523 - 1.851
R-factor	0.1806
Rwork	0.178
R-free	0.22030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2qio
RMSD bond length	0.007
RMSD bond angle	1.017
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.880
High resolution limit [Å]	1.850	1.850
Rmerge	0.055	0.459
Rpim	0.026	0.213
Number of reflections	82532	4074
<I/σ(I)>	45.2	4.8
Completeness [%]	99.9	100
Redundancy	5.6	5.6
CC(1/2)		0.899

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	295	20-45%(w/v) pentaerythritol proproxlyate (5/4 PO/OH), 0.2M NaCl, 0.1M MES, pH 6.0