1NBB

N-BUTYLISOCYANIDE BOUND RHODOBACTER CAPSULATUS CYTOCHROME C'

Experimental procedure

Temperature [K]	283
Detector technology	IMAGE PLATE
Collection date	1995-09-15
Spacegroup name	I 1 2 1
Unit cell lengths	47.734, 70.535, 89.652
Unit cell angles	90.00, 87.02, 90.00

Refinement procedure

Resolution	6.000 - 2.400
R-factor	0.174
Rwork	0.174
RMSD bond length	0.012
RMSD bond angle	21.220 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	X-PLOR (2.1)
Refinement software	X-PLOR (2.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.490
High resolution limit [Å]	2.400	2.400
Rmerge	0.129	0.261 *
Total number of observations	49034 *
Number of reflections	11056 *
<I/σ(I)>	9.28	3.1
Completeness [%]	92.0	73
Redundancy	4.44

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, sitting drop *	6.5		Tahirov, T.H., (1996) J.Mol.Biol., 259, 467. *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	20 (mg/ml)
2	1	reservoir	sodium citrate	1.5 (M)