1NLN

CRYSTAL STRUCTURE OF HUMAN ADENOVIRUS 2 PROTEINASE WITH ITS 11 AMINO ACID COFACTOR AT 1.6 ANGSTROM RESOLUTION

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X12C
Synchrotron site	NSLS
Beamline	X12C
Temperature [K]	100
Detector technology	AREA DETECTOR
Collection date	1995-08-10
Detector	MARRESEARCH
Wavelength(s)	1.15
Spacegroup name	P 61
Unit cell lengths	111.500, 111.500, 50.900
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 1.600
Rwork	0.136
R-free	0.17900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1avp
RMSD bond length	0.019
RMSD bond angle	2.100 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	50.000
High resolution limit [Å]	1.600	1.600
Rmerge	0.045	0.166
Total number of observations	166648 *
Number of reflections	44447 *
<I/σ(I)>	30.6	7.7
Completeness [%]	92.5	77.1
Redundancy	11	5.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	McGrath, W.J., (1996) J. Struct. Biol., 117, 77. *