Current trends in macromolecular model refinement and validation.

Vollmar M, Nicholls R, Antonyuk S.

Acta Crystallogr D Struct Biol, 2024

doi:10.1107/s2059798323010823.

The CCP4 suite: integrative software for macromolecular crystallography.

Agirre J, Atanasova M, Bagdonas H, Ballard CB, Baslé A, Beilsten-Edmands J, Borges RJ, Brown DG, Burgos-Mármol JJ, Berrisford JM, Bond PS, Caballero I, Catapano L, Chojnowski G, Cook AG, Cowtan KD, Croll TI, Debreczeni JÉ, Devenish NE, Dodson EJ, Drevon TR, Emsley P, Evans G, Evans PR, Fando M, Foadi J, Fuentes-Montero L, Garman EF, Gerstel M, Gildea RJ, Hatti K, Hekkelman ML, Heuser P, Hoh SW, Hough MA, Jenkins HT, Jiménez E, Joosten RP, Keegan RM, Keep N, Krissinel EB, Kolenko P, Kovalevskiy O, Lamzin VS, Lawson DM, Lebedev AA, Leslie AGW, Lohkamp B, Long F, Malý M, McCoy AJ, McNicholas SJ, Medina A, Millán C, Murray JW, Murshudov GN, Nicholls RA, Nicholls RA, Noble MEM, Oeffner R, Pannu NS, Parkhurst JM, Pearce N, Pereira J, Perrakis A, Powell HR, Read RJ, Rigden DJ, Rochira W, Sammito M, Sánchez Rodríguez F, Sheldrick GM, Shelley KL, Simkovic F, Simpkin AJ, Skubak P, Sobolev E, Steiner RA, Stevenson K, Tews I, Thomas JMH, Thorn A, Valls JT, Uski V, Usón I, Vagin A, Velankar S, Vollmar M, Walden H, Waterman D, Wilson KS, Winn MD, Winter G, Wojdyr M, Yamashita K.

Acta Crystallogr D Struct Biol, 2023

doi:10.1107/s2059798323003595.

Accelerating the discovery of new materials with deep learning.

Vollmar M.

IUCrJ, 2022

doi:10.1107/s2052252521013415.

Structure and activation mechanism of the human liver-type glutaminase GLS2.

Ferreira IM, Quesñay JEN, Bastos AC, Rodrigues CT, Vollmar M, Krojer T, Strain-Damerell C, Burgess-Brown NA, von Delft F, Yue WW, Dias SM, Ambrosio AL.

Biochimie, 2021

doi:10.1016/j.biochi.2021.03.009.

The predictive power of data-processing statistics.

Vollmar M, Parkhurst JM, Jaques D, Baslé A, Murshudov GN, Waterman DG, Evans G.

IUCrJ, 2020

doi:10.1107/s2052252520000895.

How best to use photons.

Winter G, Gildea RJ, Paterson NG, Beale J, Gerstel M, Axford D, Vollmar M, McAuley KE, Owen RL, Flaig R, Ashton AW, Hall DR.

Acta Crystallogr D Struct Biol, 2019

doi:10.1107/s2059798319003528.

DIALS: implementation and evaluation of a new integration package.

Winter G, Waterman DG, Parkhurst JM, Brewster AS, Gildea RJ, Gerstel M, Fuentes-Montero L, Vollmar M, Michels-Clark T, Young ID, Sauter NK, Evans G.

Acta Crystallogr D Struct Biol, 2018

doi:10.1107/s2059798317017235.

Background modelling of diffraction data in the presence of ice rings.

Parkhurst JM, Thorn A, Vollmar M, Winter G, Waterman DG, Fuentes-Montero L, Gildea RJ, Murshudov GN, Evans G.

IUCrJ, 2017

doi:10.1107/s2052252517010259.

AUSPEX: a graphical tool for X-ray diffraction data analysis.

Thorn A, Parkhurst J, Emsley P, Nicholls RA, Vollmar M, Evans G, Murshudov GN.

Acta Crystallogr D Struct Biol, 2017

doi:10.1107/s205979831700969x.

Inter-domain communication of human cystathionine β-synthase: structural basis of S-adenosyl-L-methionine activation.

McCorvie TJ, Kopec J, Hyung SJ, Fitzpatrick F, Feng X, Termine D, Strain-Damerell C, Vollmar M, Fleming J, Janz JM, Bulawa C, Yue WW.

J Biol Chem, 2014

doi:10.1074/jbc.m114.610782.

Ribosomal oxygenases are structurally conserved from prokaryotes to humans.

Chowdhury R, Sekirnik R, Brissett NC, Krojer T, Ho CH, Ng SS, Clifton IJ, Ge W, Kershaw NJ, Fox GC, Muniz JRC, Vollmar M, Phillips C, Pilka ES, Kavanagh KL, von Delft F, Oppermann U, McDonough MA, Doherty AJ, Schofield CJ.

Nature, 2014

doi:10.1038/nature13263.

Human UTY(KDM6C) is a male-specific Nϵ-methyl lysyl demethylase.

Walport LJ, Hopkinson RJ, Vollmar M, Madden SK, Gileadi C, Oppermann U, Schofield CJ, Johansson C.

J Biol Chem, 2014

doi:10.1074/jbc.m114.555052.

Crystal structures of malonyl-coenzyme A decarboxylase provide insights into its catalytic mechanism and disease-causing mutations.

Froese DS, Forouhar F, Tran TH, Vollmar M, Kim YS, Lew S, Neely H, Seetharaman J, Shen Y, Xiao R, Acton TB, Everett JK, Cannone G, Puranik S, Savitsky P, Krojer T, Pilka ES, Kiyani W, Lee WH, Marsden BD, von Delft F, Allerston CK, Spagnolo L, Gileadi O, Montelione GT, Oppermann U, Yue WW, Tong L.

Structure, 2013

doi:10.1016/j.str.2013.05.001.

Crystal structures of the endoplasmic reticulum aminopeptidase-1 (ERAP1) reveal the molecular basis for N-terminal peptide trimming.

Kochan G, Krojer T, Harvey D, Fischer R, Chen L, Vollmar M, von Delft F, Kavanagh KL, Brown MA, Bowness P, Wordsworth P, Kessler BM, Oppermann U.

Proc Natl Acad Sci U S A, 2011

doi:10.1073/pnas.1101262108.

Identification of macrodomain proteins as novel O-acetyl-ADP-ribose deacetylases.

Chen D, Vollmar M, Rossi MN, Phillips C, Kraehenbuehl R, Slade D, Mehrotra PV, von Delft F, Crosthwaite SK, Gileadi O, Denu JM, Ahel I.

J Biol Chem, 2011

doi:10.1074/jbc.m110.206771.

Structure of the c14 rotor ring of the proton translocating chloroplast ATP synthase.

Vollmar M, Schlieper D, Winn M, Büchner C, Groth G.

J Biol Chem, 2009

doi:10.1074/jbc.m109.006916.