4DM3

Crystal structure of human PNMT in complex adohcy, resorcinol and imidazole

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	OTHER
Wavelength(s)	1.5418
Spacegroup name	P 43 21 2
Unit cell lengths	93.908, 93.908, 188.615
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.563 - 2.400
R-factor	0.2227
Rwork	0.220
R-free	0.27520
Structure solution method	PDB ENTRY 3KPY
RMSD bond length	0.009
RMSD bond angle	1.150
Refinement software	PHENIX ((phenix.refine: 1.6_289))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.563	2.490
High resolution limit [Å]	2.400	2.400
Rmerge	0.096	0.276
Number of reflections	30511
Completeness [%]	90.2	75
Redundancy	4.91	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1