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8C4X
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BU of 8c4x by Molmil
PAM Protease
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, ...
Authors:Nomme, J, Gavalda, S, Cioci, G, Guicherd, M, Marty, A, Duquesne, S, Ben Khaled, M.
Deposit date:2023-01-05
Release date:2024-07-17
Last modified:2024-07-31
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:An engineered enzyme embedded into PLA to make self-biodegradable plastic.
Nature, 2024
6XXQ
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BU of 6xxq by Molmil
Crystal structure of spectinomycin adenyltransferase AAD(9) from Enterococcus faecialis with ATP and spectinomycin
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, SODIUM ION, ...
Authors:Kanchugal P, S, Selmer, M.
Deposit date:2020-01-28
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structural Recognition of Spectinomycin by Resistance Enzyme ANT(9) from Enterococcus faecalis.
Antimicrob.Agents Chemother., 64, 2020
6XU2
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BU of 6xu2 by Molmil
Human karyopherin RanBP5 (isoform-3)
Descriptor: Antipain, Importin-5, NICKEL (II) ION
Authors:Swale, C, McCarthy, A.A, Berger, I, Bieniossek, C, Delmas, B, Ruigrok, R.W.H, Crepin, T.
Deposit date:2020-01-17
Release date:2020-04-22
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.834 Å)
Cite:X-ray Structure of the Human Karyopherin RanBP5, an Essential Factor for Influenza Polymerase Nuclear Trafficking.
J.Mol.Biol., 432, 2020
6XZ0
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BU of 6xz0 by Molmil
Crystal structure of spectinomycin adenyltransferase AAD(9) from Enterococcus faecialis with spectinomycin
Descriptor: SPECTINOMYCIN, Streptomycin 3''-adenylyltransferase
Authors:Kanchugal P, S, Selmer, M.
Deposit date:2020-01-31
Release date:2020-04-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural Recognition of Spectinomycin by Resistance Enzyme ANT(9) from Enterococcus faecalis.
Antimicrob.Agents Chemother., 64, 2020
2XE4
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BU of 2xe4 by Molmil
Structure of Oligopeptidase B from Leishmania major
Descriptor: ANTIPAIN, CHLORIDE ION, GLYCEROL, ...
Authors:McLuskey, K, Paterson, N.G, Bland, N.D, Mottram, J.C, Isaacs, N.W.
Deposit date:2010-05-11
Release date:2010-10-06
Last modified:2019-05-15
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Crystal Structure of Leishmania Major Oligopeptidase B Gives Insight Into the Enzymatic Properties of a Trypanosomatid Virulence Factor.
J.Biol.Chem., 285, 2010
6XTE
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BU of 6xte by Molmil
Human karyopherin RanBP5 (isoform-1)
Descriptor: Antipain, CHLORIDE ION, Importin-5, ...
Authors:Swale, C, McCarthy, A.A, Ruigrok, R.W.H, Crepin, T.
Deposit date:2020-01-16
Release date:2020-04-22
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:X-ray Structure of the Human Karyopherin RanBP5, an Essential Factor for Influenza Polymerase Nuclear Trafficking.
J.Mol.Biol., 432, 2020
6Z28
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BU of 6z28 by Molmil
Carboxypeptidase T mutant L254N with N-sulfamoyl-L-glutamic acid
Descriptor: CALCIUM ION, Carboxypeptidase T, N-sulfamoyl-L-glutamic acid, ...
Authors:Timofeev, V.I, Akparov, V.K, Kuranova, I.P.
Deposit date:2020-05-15
Release date:2020-05-27
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:CARBOXYPEPTIDASE T MUTANT L254N WITH WITH N-SULFAMOYL-L-GLUT
To Be Published
5AWV
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BU of 5awv by Molmil
Crystal structure of glycopeptide hexose oxidase DBV29 complexed with teicoplanin
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-amino-2-deoxy-beta-D-glucopyranuronic acid, 8-METHYLNONANOIC ACID, ...
Authors:Liu, Y.C, Li, T.L.
Deposit date:2015-07-09
Release date:2015-08-19
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Interception of teicoplanin oxidation intermediates yields new antimicrobial scaffolds.
Nat. Chem. Biol., 7, 2011
8GJ4
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BU of 8gj4 by Molmil
A1 Tei: Adenylation domain 1 core construct from teicoplanin biosynthesis
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, MbtH-like short polypeptide, ...
Authors:Hansen, M.H, Cryle, M.J.
Deposit date:2023-03-14
Release date:2023-12-06
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Resurrecting ancestral antibiotics: unveiling the origins of modern lipid II targeting glycopeptides.
Nat Commun, 14, 2023
8GKM
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BU of 8gkm by Molmil
A1 Leu graft + Leu: Adenylation domain 1 core construct from teicoplanin biosynthesis, leucine selection pocket graft; leucine bound
Descriptor: ACETIC ACID, DI(HYDROXYETHYL)ETHER, LEUCINE, ...
Authors:Hansen, M.H, Cryle, M.J.
Deposit date:2023-03-20
Release date:2023-12-06
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Resurrecting ancestral antibiotics: unveiling the origins of modern lipid II targeting glycopeptides.
Nat Commun, 14, 2023
8GJP
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BU of 8gjp by Molmil
A1 Int graft: Adenylation domain 1 core construct from teicoplanin biosynthesis, intermediate selection pocket graft
Descriptor: MbtH-like short polypeptide, Non-ribosomal peptide synthetase
Authors:Hansen, M.H, Cryle, M.J.
Deposit date:2023-03-16
Release date:2023-12-06
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Resurrecting ancestral antibiotics: unveiling the origins of modern lipid II targeting glycopeptides.
Nat Commun, 14, 2023
8GIC
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BU of 8gic by Molmil
A1 Tei + Hpg: Adenylation domain 1 core construct from teicoplanin biosynthesis; 4-hydroxyphenylglycine bound
Descriptor: (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, MbtH-like short polypeptide, ...
Authors:Hansen, M.H, Cryle, M.J.
Deposit date:2023-03-14
Release date:2023-12-06
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Resurrecting ancestral antibiotics: unveiling the origins of modern lipid II targeting glycopeptides.
Nat Commun, 14, 2023
8HL8
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BU of 8hl8 by Molmil
Crystal structrue of MtdL R257K mutant
Descriptor: MANGANESE (II) ION, Transglycosylse
Authors:Li, F.D, He, C.
Deposit date:2022-11-29
Release date:2023-03-29
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structures of the NDP-pyranose mutase belonging to glycosyltransferase family 75 reveal residues important for Mn 2+ coordination and substrate binding.
J.Biol.Chem., 299, 2023
5N7Q
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BU of 5n7q by Molmil
CRYSTAL STRUCTURE OF MATURE CATHEPSIN D FROM THE TICK IXODES RICINUS (IRCD1) IN COMPLEX WITH THE INHIBITOR PEPSTATIN A
Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, PEPSTATIN A, ...
Authors:Brynda, J, Hanova, I, Hobizalova, R, Mares, M.
Deposit date:2017-02-21
Release date:2017-12-27
Last modified:2018-06-13
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Novel Structural Mechanism of Allosteric Regulation of Aspartic Peptidases via an Evolutionarily Conserved Exosite.
Cell Chem Biol, 25, 2018
3PRT
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BU of 3prt by Molmil
Mutant of the Carboxypeptidase T
Descriptor: CALCIUM ION, Carboxypeptidase T, GLYCEROL, ...
Authors:Timofeev, V.I, Akparov, V.K, Grishin, A.M, Kuranova, I.P.
Deposit date:2010-11-30
Release date:2011-11-30
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:

4GM5
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BU of 4gm5 by Molmil
Carboxypeptidase T with Sulphamoil Arginine
Descriptor: CALCIUM ION, Carboxypeptidase T, GLYCEROL, ...
Authors:Kuznetsov, S.A, Timofeev, V.I, Akparov, V.K, Kuranova, I.P.
Deposit date:2012-08-15
Release date:2013-08-21
Method:X-RAY DIFFRACTION (1.39 Å)
Cite:Carboxypeptidase T with Sulphamoil Arginine
To be Published
5T3E
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BU of 5t3e by Molmil
Crystal structure of a nonribosomal peptide synthetase heterocyclization domain.
Descriptor: Bacillamide synthetase heterocyclization domain, SULFATE ION
Authors:Bloudoff, K, Schmeing, T.M.
Deposit date:2016-08-25
Release date:2016-11-02
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.297 Å)
Cite:Structural and mutational analysis of the nonribosomal peptide synthetase heterocyclization domain provides insight into catalysis.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
1DSR
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BU of 1dsr by Molmil
Peptide antibiotic, NMR, 6 structures
Descriptor: (2Z,4E)-7-methylocta-2,4-dienoic acid, RAMOPLANIN A2, alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose
Authors:Kurz, M, Guba, W.
Deposit date:1996-07-05
Release date:1997-02-12
Last modified:2023-11-15
Method:SOLUTION NMR
Cite:3D Structure of Ramoplanin: A Potent Inhibitor of Bacterial Cell Wall Synthesis.
Biochemistry, 35, 1996
1JRS
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BU of 1jrs by Molmil
HEMIACETAL COMPLEX BETWEEN LEUPEPTIN AND TRYPSIN
Descriptor: CALCIUM ION, Leupeptin, TRYPSIN
Authors:Kurinov, I.V, Harrison, R.W.
Deposit date:1996-02-07
Release date:1996-10-14
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Two crystal structures of the leupeptin-trypsin complex.
Protein Sci., 5, 1996
1RPB
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BU of 1rpb by Molmil
SOLUTION STRUCTURE OF RP 71955, A NEW 21 AMINO ACID TRICYCLIC PEPTIDE ACTIVE AGAINST HIV-1 VIRUS
Descriptor: Tricyclic peptide RP 71955
Authors:Frechet, D, Guitton, J.D, Herman, F, Faucher, D, Helynck, G, Monegier Du Sorbier, B, Ridoux, J.P, James-Surcouf, E, Vuilhorgne, M.
Deposit date:1993-08-31
Release date:1994-01-31
Last modified:2024-06-05
Method:SOLUTION NMR
Cite:Solution structure of RP 71955, a new 21 amino acid tricyclic peptide active against HIV-1 virus.
Biochemistry, 33, 1994
1RPC
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BU of 1rpc by Molmil
SOLUTION STRUCTURE OF RP 71955, A NEW 21 AMINO ACID TRICYCLIC PEPTIDE ACTIVE AGAINST HIV-1 VIRUS
Descriptor: Tricyclic peptide RP 71955
Authors:Frechet, D, Guitton, J.D, Herman, F, Faucher, D, Helynck, G, Monegier Du Sorbier, B, Ridoux, J.P, James-Surcouf, E, Vuilhorgne, M.
Deposit date:1993-08-31
Release date:1994-01-31
Last modified:2024-06-05
Method:SOLUTION NMR
Cite:Solution structure of RP 71955, a new 21 amino acid tricyclic peptide active against HIV-1 virus.
Biochemistry, 33, 1994
1TL9
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BU of 1tl9 by Molmil
High resolution crystal structure of calpain I protease core in complex with leupeptin
Descriptor: CALCIUM ION, Calpain 1, large [catalytic] subunit, ...
Authors:Moldoveanu, T, Campbell, R.L, Cuerrier, D, Davies, P.L.
Deposit date:2004-06-09
Release date:2004-11-02
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structures of Calpain-E64 and -Leupeptin Inhibitor Complexes Reveal Mobile Loops Gating the Active Site
J.Mol.Biol., 343, 2004
1FJG
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BU of 1fjg by Molmil
STRUCTURE OF THE THERMUS THERMOPHILUS 30S RIBOSOMAL SUBUNIT IN COMPLEX WITH THE ANTIBIOTICS STREPTOMYCIN, SPECTINOMYCIN, AND PAROMOMYCIN
Descriptor: 16S RIBOSOMAL RNA, 30S RIBOSOMAL PROTEIN S10, 30S RIBOSOMAL PROTEIN S11, ...
Authors:Carter, A.P, Clemons Jr, W.M, Brodersen, D.E, Wimberly, B.T, Morgan-Warren, R.J, Ramakrishnan, V.
Deposit date:2000-08-08
Release date:2000-09-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3 Å)
Cite:Functional insights from the structure of the 30S ribosomal subunit and its interactions with antibiotics
Nature, 407, 2000
4BEN
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BU of 4ben by Molmil
R39-imipenem Acyl-enzyme crystal structure
Descriptor: (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carbox ylic acid, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, D-ALANYL-D-ALANINE CARBOXYPEPTIDASE, ...
Authors:Van Elder, D, Sauvage, E, Herman, R, Kerff, F, Rocaboy, M, Charlier, P.
Deposit date:2013-03-11
Release date:2013-03-20
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Crystal Structures of R39-Imipenem Acyl-Enzyme.
To be Published
4BCT
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BU of 4bct by Molmil
Crystal structure of kiwi-fruit allergen Act d 2
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, THAUMATIN-LIKE PROTEIN
Authors:Pavkov-Keller, T, Bublin, M, Jankovic, M, Breiteneder, H, Keller, W.
Deposit date:2012-10-03
Release date:2013-10-16
Method:X-RAY DIFFRACTION (0.98 Å)
Cite:Crystal Structure of Kiwi-Fruit Allergen Act D 2
To be Published

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