1MMW

Rat neuronal NOS heme domain with vinyl-L-NIO bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL7-1
Synchrotron site	SSRL
Beamline	BL7-1
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2001-01-07
Detector	MARRESEARCH
Wavelength(s)	1.080
Spacegroup name	P 21 21 21
Unit cell lengths	51.690, 109.980, 164.540
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.300 * - 2.000
R-factor	0.2311
Rwork	0.231
R-free	0.26600
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.006
RMSD bond angle	22.500 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.030
High resolution limit [Å]	2.000	2.000
Number of reflections	59929
<I/σ(I)>	5.7	2
Completeness [%]	93.0
Redundancy	2.6	2.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	5 *	PEG 4000, MES, ammonium acetate, pH 6.0, VAPOR DIFFUSION, SITTING DROP at 280K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	7 (mg/ml)
2	1	drop	L-VNIO	5 (mM)