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Quantum Drug hit identification tool
Drug Hit Identification Tool calculates the IC50 (Kd, Ki, pKd) value of any protein-ligand complex, docks a small-molecule in the active site of a protein and performs screening a library of compounds against a target-protein or DNA/RNA. Hit Identification Tool consists of three modules: The IC50 module, 2) Ligand Docking and 3) Library Screening modules. Drug Hit Identification Tool can run both in Windows and Linux environments.
Hit Identification overview brochure![]()
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Title: NATIVE STRUCTURE OF THE EXTRACELLULAR DOMAIN OF ERYTHROPOIETIN (EPO) RECEPTOR [EBP] |
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Functional Class: Cytokine Primary citation: Livnah, O.,Stura, E.A.,Middleton, S.A.,Johnson, D.L.,Jolliffe, L.K.,Wilson, I.A. Crystallographic evidence for preformed dimers of erythropoietin receptor before ligand activation. Science v283 pp.987-990, 1999 |
Abstract Title: Crystallographic evidence for preformed dimers of erythropoietin receptor before ligand activation.
Keywords: Beta, D1erna2, Fragments, Protein-tyrosine, Humans, Support, Integral, Kinase, Receptors, Research, Cell, Hematopoietin/interferon-class, Receptor, Hydrogen, Membrane, D1ernb2, (homo, Molecular, D1ernb1, (1ern:a,, Dimerization, Sandwich, Peptide, 1erna2, 1erna1, Models, Transmembrane, Conformation, Beta, Sapiens), Membrane, Beta-sandwich, Protein, Type, Ligands, Proto-oncogene, Sapiens, (epo), D1erna1, Cytokine, Cyclic, (erythropoietin, U.s., Proteins, Peptides, P.h.s., Non-u.s., Immunoglobulin-like, Erythropoietin, 1ernb2, Proteins, Bonding, Fibronectin, Homo, Receptor), Human, Activity, Mainly, Protein, Crystallography, Gov't, (d200-domain), X-ray, 1ernb1, Machinery, Predictive powers, Simulation, Accuracy, Dissociation, Constant, Ligand docking, Performance, Kd, Relative selectivity, Associated, Confirmed, Yielded, Van der waals, Nanomolar, Correlation, Known, Cadd, Experimental, Comparison, Binding constant, Protein-ligand complexes, Proof of concept, Average, Absolute, Error, Kj/mol, Relative error, Rmsd, Applications, Technology developers, Platform, Range, Outstanding, Pkd, Molar, Dissolution, Dissociation constant, Pk, Receptor, Ab-initio, First principals chemoinformatics, Sar and pharmacological studies, Multigrid methods, Local optimization, Identification of low energy, Temperature, Nmol, Entropy contribution, Discativate,







