9ULH

Drosophila melanogaster Nicotinamidase in Complex with Inhibitor AAM

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	195
Detector technology	PIXEL
Collection date	2025-03-26
Detector	DECTRIS PILATUS3 X CdTe 1M
Wavelength(s)	0.97918
Spacegroup name	C 1 2 1
Unit cell lengths	74.930, 70.466, 76.141
Unit cell angles	90.00, 94.58, 90.00

Refinement procedure

Resolution	43.600 - 1.561
R-factor	0.2272
Rwork	0.226
R-free	0.25890
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.022
RMSD bond angle	1.145
Data reduction software	autoPX
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.600
High resolution limit [Å]	1.560	6.900	1.560
Number of reflections	55268	662	4050
<I/σ(I)>	10.83
Completeness [%]	98.8
Redundancy	6.68
CC(1/2)	0.972	0.984	0.011

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M HEPES, 1.0 M Sodium citrate (pH 7.5)