1BR9

HUMAN TISSUE INHIBITOR OF METALLOPROTEINASE-2

Experimental procedure

Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X11
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X11
Temperature [K]	100
Detector technology	IMAGE PLATE
Detector	MARRESEARCH
Spacegroup name	P 21 21 2
Unit cell lengths	72.050, 52.700, 46.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	15.000 - 2.100
R-factor	0.238 *
Rwork	0.238
R-free	0.27100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	BOVINE TISSUE INHIBITOR FERNANDEZ-CATALAN ET AL. 1998 EMBO J. IN PRESS
RMSD bond length	0.007
RMSD bond angle	0.024
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	15.000	2.200
High resolution limit [Å]	2.100	2.100
Rmerge	0.083	0.284
Total number of observations	100589 *
Number of reflections	10532
<I/σ(I)>	15.4	4.6
Completeness [%]	98.8	98.5
Redundancy	10

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	8	4 *	pH 8.0

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10-15 (mg/ml)
2	1	reservoir	Tris-HCl	0.1 (M)
3	1	reservoir		0.1 (M)
4	1	reservoir	PEG400	30 (%(w/v))