4BMA

structural of Aspergillus fumigatus UDP-N-acetylglucosamine pyrophosphorylase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Spacegroup name	P 21 21 21
Unit cell lengths	55.649, 139.744, 144.744
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 2.080
R-factor	0.21455
Rwork	0.212
R-free	0.26467
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2yqs
RMSD bond length	0.018
RMSD bond angle	1.959
Phasing software	MOLREP
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.150
High resolution limit [Å]	2.080	2.080
Rmerge	0.113	0.731
Number of reflections	69198
<I/σ(I)>	11.18	2.06
Completeness [%]	98.6	99.7
Redundancy	3.8	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1