1DKD

CRYSTAL STRUCTURE OF A GROEL (APICAL DOMAIN) AND A DODECAMERIC PEPTIDE COMPLEX

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE F1
Synchrotron site	CHESS
Beamline	F1
Temperature [K]	80
Detector technology	CCD
Collection date	1998-09-17
Detector	BRANDEIS
Spacegroup name	P 1 21 1
Unit cell lengths	42.042, 134.668, 59.734
Unit cell angles	90.00, 94.38, 90.00

Refinement procedure

Resolution	25.000 - 2.100
Rwork	0.215
R-free	0.26400
RMSD bond length	0.007
RMSD bond angle	23.600 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.180
High resolution limit [Å]	2.100	2.100
Rmerge	0.077	0.303
Number of reflections	35897
<I/σ(I)>	18.6
Completeness [%]	93.2	89.9
Redundancy	4	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	8	291	PEG4K, MgCl2, TrisCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 18K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	Tris-Cl	100 (mM)
2	1	reservoir		200 (mM)
3	1	reservoir	PEG4000	30 (%)