1F63

CRYSTAL STRUCTURE OF DEOXY SPERM WHALE MYOGLOBIN MUTANT Y(B10)Q(E7)R(E10)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1998-09-01
Detector	RIGAKU RAXIS II
Spacegroup name	P 6
Unit cell lengths	91.520, 91.520, 45.980
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	15.000 - 1.800
R-factor	0.17
Rwork	0.169
R-free	0.22000
RMSD bond length	0.014
RMSD bond angle	1.200
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	FFT ((POINT MUTANT))
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	15.000	15.000
High resolution limit [Å]	1.800	1.800
Rmerge	0.095	0.249
Number of reflections	19613
<I/σ(I)>	13
Completeness [%]	94.2	89.3
Redundancy	3.1	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	8.7	21 *	drop consists of equal volume of protein and reservoir solutions *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	1 (mM)
2	1	drop	sodium dithionite	10 (mM)
3	1	reservoir	ammonium sulfate	2.7 (M)
4	1	reservoir	Tris-Cl	20 (mM)