108M

SPERM WHALE MYOGLOBIN V68F N-BUTYL ISOCYANIDE AT PH 7.0

Experimental procedure

Source type	ROTATING ANODE
Source details	SIEMENS
Temperature [K]	292
Detector technology	IMAGE PLATE
Collection date	1997-03
Detector	RIGAKU
Spacegroup name	P 6
格子定数 [Å]	91.622, 91.622, 45.984
格子定数 [度]	90.00, 90.00, 120.00

精密化法

残基	5.000 - 2.670
R因子	0.124
Rwork	0.124
R-free	0.22600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SPERM WHALE MYOGLOBIN 0M D122N (DEOXY)
結合長の平均二乗偏差(RMSD) [Å]	0.028
結合角の平均二乗偏差(RMSD) [度]	2.200
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	X-PLOR (3.851)
Refinement software	X-PLOR (3.851)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	6.000	2.680
分解能 [Å] (高)	2.670	2.670
Rmerge_l_obs	0.098	0.340
独立反射数	6345
完全性 [%]	99.0	93.9
冗長性	3.52	3.56

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1		7		3.0 M AMMONIUM SULFATE, 20 MM TRIS, 1MM EDTA, PH 9.0, pH 7.0