PD Dr. Harald Lanig

Erlangen National High Performance Computing Center (NHR@FAU)

An automated calculation pipeline for differential pair interaction energies with molecular force fields using the Tinker Molecular Modeling Package (2024) Bänsch F, Daniel M, Lanig H, Steinbeck C, Zielesny A Journal article Overexpression and RNAi-mediated Knockdown of Two 3β-hydroxy-Δ5-steroid dehydrogenase Genes in Digitalis lanata Shoot Cultures Reveal Their Role in Cardenolide Biosynthesis (2023) Leykauf T, Klein J, Ernst M, Dorfner M, Ignatova A, Kreis W, Lanig H, Munkert J Journal article Key interactions in the trimolecular complex consisting of the rheumatoid arthritis-associated DRB1*04:01 molecule, the major glycosylated collagen II peptide and the T-cell receptor (2022) Ge C, Weisse S, Xu B, Dobritzsch D, Viljanen J, Kihlberg J, Do NN, et al. Journal article Identifying structural features for changing substrate preferences in two Plantago PRISEs (pro-gesterone 5 beta-reductase and / or iridoid synthase) (2021) Dorfner M, Klein J, Lanig H, Kreis W, Munkert J Conference contribution In silico, in vitro, and structural investigations on BAHD-enzymes from different species able to malonylate 21-hydroxypregnanes (2021) Tropper M, Wolf LS, Lanig H, Kreis W Conference contribution 21-Hydroxypregnane 21-O-malonylation, a crucial step in cardenolide biosynthesis, can be achieved by substrate-promiscuous BAHD-type phenolic glucoside malonyltransferases from Arabidopsis thaliana and homolog proteins from Digitalis lanata (2021) Tropper M, Höhn S, Wolf LS, Fritsch J, Kastner-Detter N, Rieck C, Munkert J, et al. Journal article, Original article Synthesis, Radiosynthesis and Biological Evaluation of Buprenorphine-Derived Phenylazocarboxamides as Novel mu-Opioid Receptor Ligands (2020) Krüll J, Fehler S, Hofmann L, Nebel N, Maschauer S, Prante O, Gmeiner P, et al. Journal article, Original article If you do not try, you will never know!: Foreword for the Tim Clark 70th Birthday Festschrift (2020) Jäger CM, Lanig H Journal article Molecular dynamics simulations on human fibulin-4 mutants D203A and E126K reveal conformational changes in EGF domains potentially responsible for enhanced protease lability and impaired extracellular matrix assembly (2019) Sasaki T, von der Mark K, Lanig H Journal article, Original article Molecular Dynamics (2018) Lanig H Book chapter / Article in edited volumes