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4JMW

Crystal structure of Cytochrome C Peroxidase W191G-Gateless in complex with Phenol

Summary for 4JMW
Entry DOI10.2210/pdb4jmw/pdb
Related1KXM 1KXN 4JM5 4JM6 4JM8 4JM9 4JMA
DescriptorCytochrome c peroxidase, PROTOPORPHYRIN IX CONTAINING FE, PHENOL, ... (4 entities in total)
Functional Keywordsmodel system, bulk solvent, ordered waters, docking, ligand binding, free energy calculation, molecular dynamics, oxidoreductase
Biological sourceSaccharomyces cerevisiae (Baker's yeast)
Total number of polymer chains1
Total formula weight33733.29
Authors
Fischer, M.,Fish, I. (deposition date: 2013-03-14, release date: 2013-05-01, Last modification date: 2024-02-28)
Primary citationRocklin, G.J.,Boyce, S.E.,Fischer, M.,Fish, I.,Mobley, D.L.,Shoichet, B.K.,Dill, K.A.
Blind prediction of charged ligand binding affinities in a model binding site.
J.Mol.Biol., 425:4569-4583, 2013
Cited by
PubMed: 23896298
DOI: 10.1016/j.jmb.2013.07.030
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.19 Å)
Structure validation

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