4UCT

Fragment bound to H.influenza NAD dependent DNA ligase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	CCD
Collection date	2005-07-04
Detector	RIGAKU CCD
Spacegroup name	P 43 21 2
Unit cell lengths	138.210, 138.210, 56.022
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.410 - 2.100
R-factor	0.1909
Rwork	0.190
R-free	0.21420
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.000
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	AMoRE
Refinement software	BUSTER (2.11.5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.000	2.210
High resolution limit [Å]	2.100	2.100
Rmerge	0.070	0.600
Number of reflections	37808
<I/σ(I)>	14	2.2
Completeness [%]	99.1	99.8
Redundancy	4.9	4.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1