1XRN

Crystal structure of active site F1-mutant E213Q soaked with peptide Phe-Ala

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU300
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2003-04-27
Detector	MARRESEARCH
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	57.330, 61.510, 80.580
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	10.940 - 2.800
R-factor	0.256
Rwork	0.256
R-free	0.32900
RMSD bond length	0.008
RMSD bond angle	1.000
Data reduction software	MOSFLM
Data scaling software	CCP4 ((TRUNCATE))
Phasing software	CNS
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.900	2.870
High resolution limit [Å]	2.400	2.800
Number of reflections	9279
<I/σ(I)>	16.4
Completeness [%]	99.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	PEG 6000, Bis-Tris, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K