4I5Y

Insulin protein crystallization via langmuir-blodgett

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM14
Synchrotron site	ESRF
Beamline	BM14
Wavelength(s)	0.932
Spacegroup name	I 21 3
Unit cell lengths	78.200, 78.200, 78.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	55.300 - 1.800
R-factor	0.1841
Rwork	0.182
R-free	0.22220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.027
RMSD bond angle	2.035
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.16)
Phasing software	MOLREP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	55.300	20.900	1.900
High resolution limit [Å]	1.800	5.690	1.800
Rmerge		0.064	0.341
Rmeas		0.066	0.350
Rpim		0.015	0.077
Total number of observations		5191	22885
Number of reflections	7540
<I/σ(I)>	25.1	41.3	9.8
Completeness [%]	99.9	98.3	100
Redundancy	21.1	20.1	20.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1