3LLL

Crystal structure of mouse pacsin2 F-BAR domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2007-06-07
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.54
Spacegroup name	P 21 21 21
Unit cell lengths	104.390, 106.400, 125.000
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.195 - 3.300
R-factor	0.2577
Rwork	0.256
R-free	0.29700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3haj (human PACSIN 2)
RMSD bond length	0.001
RMSD bond angle	0.402
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.200	3.500
High resolution limit [Å]	3.300	3.300
Number of reflections	20356
<I/σ(I)>	3.9	1.1
Completeness [%]	95.7	96.2
Redundancy	4.2	4.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	300	1:1 mixture of 20mg/mL mPACSIN2 and reservoir containing 0.1M HEPES/NaOH pH7.5, 1.62-1.66M (NH4)2SO4, 0.03M KBr, 4-4.5% PEG-MME 550, VAPOR DIFFUSION, SITTING DROP, temperature 300K