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1DMA

DOMAIN III OF PSEUDOMONAS AERUGINOSA EXOTOXIN COMPLEXED WITH NICOTINAMIDE AND AMP

Experimental procedure
Spacegroup nameP 43 21 2
Unit cell lengths87.510, 87.510, 134.080
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 2.500
R-factor0.195
Rwork0.195
R-free0.26400

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RMSD bond length0.019
RMSD bond angle26.200

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Refinement softwareX-PLOR (3.1)
Data quality characteristics
 Overall
Low resolution limit [Å]8.000
High resolution limit [Å]2.500
Rmerge0.068

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Number of reflections16513
Completeness [%]88.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

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7

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used as seeds

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Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirsodium citrate1.5 (M)
21reservoirNAD40 (mM)
31dropPEIII10 (mg/ml)
41dropTris-HCl10 (mM)
51drop0.1 (M)
61dropsodium citrate1.5 (M)
71dropNAD40 (mM)

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PDB entries from 2024-09-04

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