3LVE

LEN Q38E MUTANT: A DOMAIN FLIP FROM A SINGLE AMINO ACID SUBSTITUTION

Experimental procedure

Source type	ROTATING ANODE
Source details	RIGAKU RUH2R
Temperature [K]	120
Detector technology	IMAGE PLATE
Collection date	1996-05
Detector	RIGAKU
Spacegroup name	P 42 2 2
Unit cell lengths	65.300, 65.300, 51.400
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.000
R-factor	0.176
Rwork	0.176
R-free	0.24800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1lve
RMSD bond length	0.006
RMSD bond angle	27.800 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	X-PLOR (3.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	99.000	2.040
High resolution limit [Å]	2.000	2.000
Rmerge	0.101	0.310
Number of reflections	8076
<I/σ(I)>	40	6.8
Completeness [%]	98.9	89
Redundancy	20.4	6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	6.5		pH 6.5

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10 (mg/ml)
2	1	drop	PEG8000	18 (%)
3	1	drop	sodium cacodylate	0.1 (M)
4	1	drop	zinc acetate	0.2 (M)