8OO4

X-ray structure of the adduct formed upon reaction of cisplatin with human angiogenin after 1 month soaking

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ELETTRA BEAMLINE 11.2C
Synchrotron site	ELETTRA
Beamline	11.2C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-03-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00
Spacegroup name	P 21 21 2
Unit cell lengths	85.250, 37.510, 38.160
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.625 - 1.990
Rwork	0.308
R-free	0.36720
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	1.526
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.630	2.020
High resolution limit [Å]	1.769	1.990
Rmerge	0.082	0.566
Number of reflections	10455	414
<I/σ(I)>	17.1	2.4
Completeness [%]	95.3	98.1
Redundancy	10	5.1
CC(1/2)	0.996	0.927

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	10% PEG6K, 20 mM sodium citrate pH 5.1, 0.2 M sodium/potassium tartrate