7UXM

Structure of PPIA in complex with FP29092, a Helicon Polypeptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL45XU
Synchrotron site	SPring-8
Beamline	BL45XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	56.000, 73.270, 113.210
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.790 - 1.200
R-factor	0.1625
Rwork	0.161
R-free	0.18960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3k0n
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.790	1.240
High resolution limit [Å]	1.200	1.200
Rmerge		1.380
Number of reflections	145752	14438
<I/σ(I)>	13.3
Completeness [%]	100.0
Redundancy	13.3
CC(1/2)	0.999	0.753

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.15 M Potassium bromide, 30% w/v Polyethylene glycol monomethyl ether 2,000