6zfw | pdb_00006zfw

X-ray structure of the soluble N-terminal domain of T. cruzi PEX-14

spinqualitylabelsall models 6zfw, resolution 1.58Å Show:Asymmetric Unit Biological Assembly Drag the structure with the mouse to rotate   Export Animated Image   Print3D Structural highlights 6zfw is a 5 chain structure with sequence from Trycr. Full crystallographic information is available from OCA. For a guided tour on the structure components use FirstGlance. Ligands: ACT, BME, GOL Gene: C3747_80g13 (TRYCR) Resources: FirstGlance, OCA, PDBe, RCSB, PDBsum, ProSAT Function [A0A2V2WKZ5_TRYCR] Component of the peroxisomal translocation machinery.[RuleBase:RU367032] Publication Abstract from PubMed We develop a residual deep learning model, hotWater (https://pypi.org/project/hotWater/), to identify key water interaction sites on proteins for binding models and drug discovery. This is tested on new crystal structures, as well as cryo-EM and NMR structures from the PDB and in crystallographic refinement with promising results. Deep learning model predicts water interaction sites on the surface of proteins using limited-resolution data.,Zaucha J, Softley CA, Sattler M, Frishman D, Popowicz GM Chem Commun (Camb). 2020 Nov 25. doi: 10.1039/d0cc04383d. PMID:33237041 From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.

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