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4BUE
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BU of 4bue by Molmil
Crystal structure of human tankyrase 2 in complex with 3-methyl-N-(4-(4-oxo-3,4-dihydroquinazolin-2-yl)phenyl)butanamide
Descriptor: 3-METHYL-N-[4-(4-OXO-3,4-DIHYDROQUINAZOLIN-2-YL)PHENYL)BUTANAMIDE, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
Authors:Haikarainen, T, Narwal, M, Lehtio, L.
Deposit date:2013-06-20
Release date:2013-10-30
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Para-Substituted 2-Phenyl-3,4-Dihydroquinazolin-4-Ones as Potent and Selective Tankyrase Inhibitors.
Chemmedchem, 8, 2013
6FJ1
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BU of 6fj1 by Molmil
Structure of the Ldtfm-avibactam carbamoyl enzyme
Descriptor: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, 3,6,9,12,15-PENTAOXAHEPTADECANE, CHLORIDE ION, ...
Authors:Li de la Sierra Gallay, I, Iannazzo, L, Compain, F, Fonvielle, M, van Tilbeurgh, H, Edoo, Z, Arthur, M, Etheve-Quelquejeu, M, Hugonnet, J.
Deposit date:2018-01-19
Release date:2019-01-30
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.69 Å)
Cite:Synthesis of Avibactam Derivatives and Activity on beta-Lactamases and Peptidoglycan Biosynthesis Enzymes of Mycobacteria.
Chemistry, 24, 2018
4AUQ
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BU of 4auq by Molmil
Structure of BIRC7-UbcH5b-Ub complex.
Descriptor: BACULOVIRAL IAP REPEAT-CONTAINING PROTEIN 7, POLYUBIQUITIN-C, UBIQUITIN-CONJUGATING ENZYME E2 D2, ...
Authors:Dou, H, Buetow, L, Sibbet, G.J, Cameron, K, Huang, D.T.
Deposit date:2012-05-21
Release date:2012-08-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.176 Å)
Cite:Birc7-E2 Ubiquitin Conjugate Structure Reveals the Mechanism of Ubiquitin Transfer by a Ring Dimer.
Nat.Struct.Mol.Biol., 19, 2012
1ORX
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BU of 1orx by Molmil
Solution Structure of the acyclic permutant des-(24-28)-kalata B1.
Descriptor: kalata B1
Authors:Barry, D.G, Daly, N.L, Clark, R.J, Sando, L, Craik, D.J.
Deposit date:2003-03-17
Release date:2003-06-24
Last modified:2024-10-09
Method:SOLUTION NMR
Cite:Linearization of a naturally occurring circular protein maintains structure but eliminates hemolytic activity
Biochemistry, 42, 2003
1OSD
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BU of 1osd by Molmil
crystal structure of Oxidized MerP from Ralstonia metallidurans CH34
Descriptor: hypothetical protein MerP
Authors:Serre, L, Rossy, E, Pebay-Peyroula, E, Cohen-Addad, C, Coves, J.
Deposit date:2003-03-19
Release date:2004-05-18
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structure of the Oxidized Form of the Periplasmic Mercury-binding Protein MerP from Ralstonia metallidurans CH34
J.MOL.BIOL., 339, 2004
5N6L
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BU of 5n6l by Molmil
Structure of the membrane integral lipoprotein N-acyltransferase Lnt C387A mutant from E. coli
Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, Apolipoprotein N-acyltransferase, GLYCEROL
Authors:Huang, C.-Y, Boland, C, Howe, N, Wiktor, M, Vogeley, L, Weichert, D, Bailey, J, Olieric, V, Wang, M, Caffrey, M.
Deposit date:2017-02-15
Release date:2017-07-12
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structural insights into the mechanism of the membrane integral N-acyltransferase step in bacterial lipoprotein synthesis.
Nat Commun, 8, 2017
3SZN
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BU of 3szn by Molmil
Crystal structure of SARS coronavirus main protease complexed with an alpha, beta-unsaturated ethyl ester SG75
Descriptor: 3C-like proteinase, ETHYL (4R)-4-({N-[(BENZYLOXY)CARBONYL]-L-PHENYLALANYL}AMINO)-5-[(3S)-2-OXOPYRROLIDIN-3-YL]PENTANOATE
Authors:Zhu, L, Hilgenfeld, R.
Deposit date:2011-07-19
Release date:2012-07-25
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Crystal structures of SARS-Cov main protease complexed with a series of unsaturated esters
To be Published
6FQF
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BU of 6fqf by Molmil
THE X-RAY STRUCTURE OF FERRIC-BETA4 HUMAN HEMOGLOBIN
Descriptor: Hemoglobin subunit beta, PROTOPORPHYRIN IX CONTAINING FE
Authors:Mazzarella, L, Merlino, A, Balasco, N, Balsamo, A, Vergara, A.
Deposit date:2018-02-14
Release date:2018-06-13
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structure of the ferric homotetrameric beta4human hemoglobin.
Biophys. Chem., 240, 2018
1E20
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BU of 1e20 by Molmil
The FMN binding protein AtHal3
Descriptor: BETA-MERCAPTOETHANOL, FLAVIN MONONUCLEOTIDE, HALOTOLERANCE PROTEIN HAL3, ...
Authors:Albert, A, Martinez-Ripoll, M, Espinosa-Ruiz, A, Yenush, L, Culianez-Macia, F.A, Serrano, R.
Deposit date:2000-05-12
Release date:2000-09-11
Last modified:2018-10-24
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:The X-Ray Structure of the Fmn-Binding Protein Athal3 Provides the Structural Basis for the Activity of a Regulatory Subunit Involved in Signal Transduction
Structure, 8, 2000
4B3P
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BU of 4b3p by Molmil
Structures of HIV-1 RT and RNA-DNA Complex Reveal a Unique RT Conformation and Substrate Interface
Descriptor: DNA, P51 RT, REVERSE TRANSCRIPTASE/RIBONUCLEASE H, ...
Authors:Lapkouski, M, Tian, L, Miller, J.T, Le Grice, S.F.J, Yang, W.
Deposit date:2012-07-25
Release date:2013-01-16
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (4.839 Å)
Cite:Complexes of HIV-1 RT, Nnrti and RNA/DNA Hybrid Reveal a Structure Compatible with RNA Degradation
Nat.Struct.Mol.Biol., 20, 2013
4B2X
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BU of 4b2x by Molmil
Pseudomonas aeruginosa RmlA in complex with allosteric inhibitor
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 6-amino-1-butyl-5-(cyclopentylamino)pyrimidine-2,4(1H,3H)-dione, CHLORIDE ION, ...
Authors:Alphey, M.S, Pirrie, L, Torrie, L.S, Gardiner, M, Sarkar, A, Brenk, R, Westwood, N.J, Gray, D, Naismith, J.H.
Deposit date:2012-07-18
Release date:2012-10-31
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Allosteric competitive inhibitors of the glucose-1-phosphate thymidylyltransferase (RmlA) from Pseudomonas aeruginosa.
ACS Chem. Biol., 8, 2013
1OUV
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BU of 1ouv by Molmil
Helicobacter cysteine rich protein C (HcpC)
Descriptor: conserved hypothetical secreted protein
Authors:Mittl, P.R, Luethy, L.
Deposit date:2003-03-25
Release date:2004-03-30
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Crystal Structure of Helicobacter Cysteine-rich Protein C at 2.0A Resolution: Similar Peptide-binding Sites in TPR and SEL1-like Repeat Proteins
J.Mol.Biol., 340, 2004
5YH8
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BU of 5yh8 by Molmil
The crystal structure of Staphylococcus aureus CntA in complex with staphylopine and nickel
Descriptor: (2~{S})-4-[[(2~{R})-3-(1~{H}-imidazol-4-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-[[(2~{S})-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
Authors:Ji, Q, Song, L.
Deposit date:2017-09-27
Release date:2018-03-28
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Mechanistic insights into staphylopine-mediated metal acquisition
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
1E1S
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BU of 1e1s by Molmil
Human prion protein variant S170N
Descriptor: PRION PROTEIN
Authors:Calzolai, L, Lysek, D.A, Guntert, P, Von Schroetter, C, Zahn, R, Riek, R, Wuthrich, K.
Deposit date:2000-05-10
Release date:2000-07-21
Last modified:2024-10-23
Method:SOLUTION NMR
Cite:NMR Structures of Three Single-Residue Variants of the Human Prion Protein
Proc.Natl.Acad.Sci.USA, 97, 2000
5YHE
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BU of 5yhe by Molmil
The crystal structure of Staphylococcus aureus CntA in complex with staphylopine and cobalt
Descriptor: (2~{S})-4-[[(2~{R})-3-(1~{H}-imidazol-4-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-[[(2~{S})-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid, ACETATE ION, CHLORIDE ION, ...
Authors:Song, L, Ji, Q.
Deposit date:2017-09-28
Release date:2018-03-28
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.465 Å)
Cite:Mechanistic insights into staphylopine-mediated metal acquisition
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
1OP4
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BU of 1op4 by Molmil
Solution Structure of Neural Cadherin Prodomain
Descriptor: Neural-cadherin
Authors:Koch, A.W, Farooq, A, Shan, W, Zeng, L, Colman, D.R, Zhou, M.-M.
Deposit date:2003-03-04
Release date:2004-03-16
Last modified:2022-02-23
Method:SOLUTION NMR
Cite:Structure of the Neural (N-) Cadherin Prodomain Reveals a Cadherin Extracellular Domain-like Fold without Adhesive Characteristics
Structure, 12, 2004
1OYL
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BU of 1oyl by Molmil
Crystal Structures of the Ferric, Ferrous, and Ferrous-NO Forms of the Asp140Ala Mutant of Human Heme Oxygenase-1: Catalytic Implications
Descriptor: Heme oxygenase 1, PROTOPORPHYRIN IX CONTAINING FE
Authors:Lad, L, Wang, J, Li, H, Friedman, J, Ortiz de Montellano, P.R, Poulos, T.L.
Deposit date:2003-04-05
Release date:2003-08-05
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:Crystal structures of the ferric, ferrous, and ferrous-NO forms of the Asp140Ala mutant of human heme oxygenase-1: catalytic implications
J.Mol.Biol., 330, 2003
1OQV
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BU of 1oqv by Molmil
Structure of TcpA, the Type IV pilin subunit from the toxin co-regulated pilus of Vibrio cholerae classical biotype
Descriptor: GLYCEROL, toxin-coregulated pilus subunit
Authors:Craig, L, Tainer, J.A.
Deposit date:2003-03-11
Release date:2003-06-03
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Type IV Pilin Structure and Assembly: X-Ray and EM Analyses of Vibrio cholerae Toxin-Coregulated Pilus and Pseudomonas aeruginosa PAK Pilin
Mol.Cell, 11, 2003
1OYZ
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BU of 1oyz by Molmil
X-RAY STRUCTURE OF YIBA_ECOLI NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET ET31.
Descriptor: Hypothetical protein yibA
Authors:Kuzin, A, Semesi, A, Skarina, T, Savchenko, A, Arrowsmith, C, Tong, L, Northeast Structural Genomics Consortium (NESG)
Deposit date:2003-04-07
Release date:2003-08-12
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:X-RAY STRUCTURE OF YIBA_ECOLI NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET ET31.
To be Published
4ARV
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BU of 4arv by Molmil
Yersinia kristensenii phytase apo form
Descriptor: 1,2-ETHANEDIOL, 2,5,8,11,14,17-HEXAOXANONADECAN-19-OL, 2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXYL, ...
Authors:Ariza, A, Moroz, O.V, Blagova, E.B, Turkenburg, J.P, Vevodova, J, Roberts, S, Vind, J, Sjoholm, C, Lassen, S.F, De Maria, L, Glitsoe, V, Skov, L.K, Wilson, K.S.
Deposit date:2012-04-26
Release date:2013-05-08
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Degradation of Phytate by the 6-Phytase from Hafnia Alvei: A Combined Structural and Solution Study.
Plos One, 8, 2013
4ASY
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BU of 4asy by Molmil
Pseudomonas aeruginosa RmlA in complex with allosteric inhibitor
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, GLUCOSE-1-PHOSPHATE THYMIDYLYLTRANSFERASE, ...
Authors:Alphey, M.S, Pirrie, L, Torrie, L.S, Gardiner, M, Sarkar, A, Brenk, R, Westwood, N.J, Gray, D, Naismith, J.H.
Deposit date:2012-05-03
Release date:2012-10-31
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Allosteric competitive inhibitors of the glucose-1-phosphate thymidylyltransferase (RmlA) from Pseudomonas aeruginosa.
ACS Chem. Biol., 8, 2013
8UKC
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BU of 8ukc by Molmil
Solution NMR Structure of the lasso peptide chlorolassin
Descriptor: Lassopeptide Chlorolassin
Authors:Saad, H, Zhu, L, Harris, L.A, Shelton, K.E, Mitchell, D.A.
Deposit date:2023-10-12
Release date:2024-09-25
Method:SOLUTION NMR
Cite:Tryptophan-Centric Bioinformatics Identifies New Lasso Peptide Modifications.
Biochemistry, 63, 2024
5N5Q
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BU of 5n5q by Molmil
Human TTR altered conformation from soaking in iron chloride.
Descriptor: ACETATE ION, FE (III) ION, Transthyretin, ...
Authors:Ciccone, L, Savko, M, Shepard, W, Stura, E.A.
Deposit date:2017-02-14
Release date:2018-03-07
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.53 Å)
Cite:Copper mediated amyloid-beta binding to Transthyretin.
Sci Rep, 8, 2018
8UKG
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BU of 8ukg by Molmil
Solution NMR structure of the lasso peptide wygwalassin-A1
Descriptor: Lassopeptide wygwalassin-A1
Authors:Saad, H, Zhu, L, Harris, L.A, Shelton, K.E, Mitchell, D.A.
Deposit date:2023-10-13
Release date:2024-09-25
Method:SOLUTION NMR
Cite:Tryptophan-Centric Bioinformatics Identifies New Lasso Peptide Modifications.
Biochemistry, 63, 2024
8RKB
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BU of 8rkb by Molmil
Connector complex of bacteriophage JBD30 computed in C12 symmetry
Descriptor: DUF1320 domain-containing protein, Portal protein
Authors:Valentova, L, Fuzik, T, Plevka, P.
Deposit date:2023-12-23
Release date:2024-08-14
Last modified:2024-10-16
Method:ELECTRON MICROSCOPY (3.12 Å)
Cite:Structure and replication of Pseudomonas aeruginosa phage JBD30.
Embo J., 43, 2024

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