1LQY

Crystal Structure of Bacillus stearothermophilus Peptide Deformylase Complexed with Antibiotic Actinonin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	ENRAF-NONIUS
Temperature [K]	95
Detector technology	IMAGE PLATE
Collection date	1998-12-10
Detector	MAC Science DIP-2000
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	42.013, 43.075, 92.225
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.000 - 1.900
R-factor	0.161
Rwork	0.161
R-free	0.24200
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.017
RMSD bond angle	1.705
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	X-PLOR (98.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	1.970
High resolution limit [Å]	1.900	1.900
Rmerge	0.039 *	0.083 *
Number of reflections	13516
<I/σ(I)>	24.7	12.8
Completeness [%]	98.0	95.3
Redundancy	2.9 *	2.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	19 *	7% PEG6000, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 290K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	HEPES-HCl	25 (mM)	pH7.5
2	1	drop	PEG6000	3.5 (%)
3	1	drop	protein	0.7 (mM)
4	1	drop	actinonin	0.7 (mM)
5	1	reservoir	HEPPS-HCl	50 (mM)	pH7.5
6	1	reservoir	PEG6000	7 (%)