1YCB

DISTAL POCKET POLARITY IN LIGAND BINDING TO MYOGLOBIN: DEOXY AND CARBONMONOXY FORMS OF A THREONINE68 (E11) MUTANT INVESTIGATED BY X-RAY CRYSTALLOGRAPHY AND INFRARED SPECTROSCOPY

Experimental procedure

Spacegroup name	P 1 21 1
Unit cell lengths	124.600, 42.500, 92.000
Unit cell angles	90.00, 92.00, 90.00

Refinement procedure

Resolution	8.000 - 2.100
R-factor	0.198
RMSD bond length	0.020
RMSD bond angle	0.055
Refinement software	PROLSQ

Data quality characteristics

	Overall
High resolution limit [Å]	2.100 *
Rmerge	0.111 *
Number of reflections	18251 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	sodium phosphate	100 (mM)
2	1	drop	ammonium sulfate	70-80 (%)
3	1	drop	protein	5-6 (mg/ml)
4	1	drop	sodium dithionite		50-fold molar excess