3HUS

Crystal structure of recombinant gamma N308K fibrinogen fragment D with the peptide ligand Gly-Pro-Arg-Pro-amide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2005-04-22
Detector	ADSC QUANTUM 315
Wavelength(s)	0.99000
Spacegroup name	P 43 21 2
Unit cell lengths	95.009, 95.009, 448.382
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.250 - 3.040
R-factor	0.23768
Rwork	0.220
R-free	0.28802
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ltj
RMSD bond length	0.007
RMSD bond angle	1.039
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.0)

Data quality characteristics

	Overall
Low resolution limit [Å]	47.250
High resolution limit [Å]	3.040
Number of reflections	40798
Completeness [%]	99.4
Redundancy	8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	277	9% PEG 3350, 50 mM Tris-HCl pH 8.5, 2 mM Sodium azide, 12.5 mM Calcium chloride, VAPOR DIFFUSION, SITTING DROP, temperature 277K