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4TTO
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BU of 4tto by Molmil
Quasi-racemic structure of [V25A] kalata B1
Descriptor: D-kalata B1, Kalata-B1
Authors:Wang, C.K, King, G.J, Craik, D.J.
Deposit date:2014-06-22
Release date:2014-09-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.3002 Å)
Cite:Racemic and Quasi-Racemic X-ray Structures of Cyclic Disulfide-Rich Peptide Drug Scaffolds.
Angew.Chem.Int.Ed.Engl., 53, 2014
4TTM
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BU of 4ttm by Molmil
Racemic structure of kalata B1 (kB1)
Descriptor: D-kalata B1, Kalata-B1
Authors:Wang, C.K, King, G.J, Craik, D.J.
Deposit date:2014-06-22
Release date:2014-09-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.9001 Å)
Cite:Racemic and Quasi-Racemic X-ray Structures of Cyclic Disulfide-Rich Peptide Drug Scaffolds.
Angew.Chem.Int.Ed.Engl., 53, 2014
4TTL
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BU of 4ttl by Molmil
Racemic structure of cyclic Vc1.1 (cVc1.1-1)
Descriptor: Alpha-conotoxin Vc1A
Authors:Wang, C.K, King, G.J, Craik, D.J.
Deposit date:2014-06-22
Release date:2014-09-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.7004 Å)
Cite:Racemic and Quasi-Racemic X-ray Structures of Cyclic Disulfide-Rich Peptide Drug Scaffolds.
Angew.Chem.Int.Ed.Engl., 53, 2014
4TTK
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BU of 4ttk by Molmil
Racemic structure of Sunflower Trypsin Inhibitor-1 (SFTI-1)
Descriptor: Sunflower Trypsin Inhibitor-1 (SFTI-1) (D-form)
Authors:Wang, C.K, King, G.J, Craik, D.J.
Deposit date:2014-06-22
Release date:2014-09-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.2502 Å)
Cite:Racemic and Quasi-Racemic X-ray Structures of Cyclic Disulfide-Rich Peptide Drug Scaffolds.
Angew.Chem.Int.Ed.Engl., 53, 2014
4TTN
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BU of 4ttn by Molmil
Quasi-racemic structure of [G6A]kalata B1
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, D-kalata B1, Kalata-B1
Authors:Wang, C.K, King, G.J, Craik, D.J.
Deposit date:2014-06-22
Release date:2014-09-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.2507 Å)
Cite:Racemic and Quasi-Racemic X-ray Structures of Cyclic Disulfide-Rich Peptide Drug Scaffolds.
Angew.Chem.Int.Ed.Engl., 53, 2014
5INZ
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BU of 5inz by Molmil
Racemic structure of baboon theta defensin-2
Descriptor: 1,2-ETHANEDIOL, SULFATE ION, Theta defensin-2, ...
Authors:Wang, C.K, King, G.J, Conibear, A.C, Ramos, M.C, Craik, D.J.
Deposit date:2016-03-08
Release date:2016-04-27
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.447 Å)
Cite:Mirror Images of Antimicrobial Peptides Provide Reflections on Their Functions and Amyloidogenic Properties.
J.Am.Chem.Soc., 138, 2016
2KHB
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BU of 2khb by Molmil
Solution structure of linear kalata B1 (loop 6)
Descriptor: Kalata-B1
Authors:Wang, C.K, Craik, D.J.
Deposit date:2009-04-01
Release date:2010-03-31
Last modified:2022-03-16
Method:SOLUTION NMR
Cite:Cyclotides insert into lipid bilayers to form membrane pores and destabilize the membrane
To be Published
2K7G
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BU of 2k7g by Molmil
Solution Structure of varv F
Descriptor: Varv peptide F
Authors:Wang, C.K.
Deposit date:2008-08-10
Release date:2009-02-10
Last modified:2022-03-16
Method:SOLUTION NMR
Cite:Combined X-ray and NMR analysis of the stability of the cyclotide cystine knot fold that underpins its insecticidal activity and potential use as a drug scaffold
J.Biol.Chem., 284, 2009
2KCG
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BU of 2kcg by Molmil
Solution structure of cycloviolacin O2
Descriptor: Cycloviolacin-O2
Authors:Wang, C.K.
Deposit date:2008-12-22
Release date:2009-07-21
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Despite a conserved cystine knot motif, different cyclotides have different membrane binding modes.
Biophys.J., 97, 2009
2KCH
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BU of 2kch by Molmil
Solution structure of micelle-bound kalata B2
Descriptor: Kalata-B2
Authors:Wang, C.K.
Deposit date:2008-12-21
Release date:2009-07-21
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Despite a conserved cystine knot motif, different cyclotides have different membrane binding modes.
Biophys.J., 97, 2009
2KVX
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BU of 2kvx by Molmil
Solution structure of kalata B12
Descriptor: Kalata-B12
Authors:Wang, C.K.
Deposit date:2010-03-29
Release date:2011-03-09
Last modified:2016-06-01
Method:SOLUTION NMR
Cite:The role of conserved Glu residue on cyclotide stability and activity: a structural and functional study of kalata B12, a naturally occurring Glu to Asp mutant.
Biochemistry, 50, 2011
6DKZ
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BU of 6dkz by Molmil
Racemic structure of ribifolin, an orbitide from Jatropha ribifolia
Descriptor: ribifolin
Authors:Wang, C.K, King, G.J, Ramalho, S.D.
Deposit date:2018-05-31
Release date:2018-11-14
Last modified:2020-01-01
Method:X-RAY DIFFRACTION (0.99 Å)
Cite:Synthesis, Racemic X-ray Crystallographic, and Permeability Studies of Bioactive Orbitides from Jatropha Species.
J. Nat. Prod., 81, 2018
6DKY
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BU of 6dky by Molmil
Crystal structure of ribifolin, an orbitide from Jatropha ribifolia
Descriptor: ILE-LEU-GLY-SER-ILE-ILE-LEU-GLY
Authors:Wang, C.K, Ramalho, S.D, King, G.J, Craik, D.J.
Deposit date:2018-05-31
Release date:2018-11-07
Last modified:2020-01-01
Method:X-RAY DIFFRACTION (1.239 Å)
Cite:Synthesis, Racemic X-ray Crystallographic, and Permeability Studies of Bioactive Orbitides from Jatropha Species.
J. Nat. Prod., 81, 2018
6DL1
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BU of 6dl1 by Molmil
Racemic structure of jatrophidin, an orbitide from Jatropha curcas
Descriptor: jatrophidin
Authors:Wang, C.K, King, G.J, Ramalho, S.D.
Deposit date:2018-05-31
Release date:2018-11-14
Last modified:2020-01-01
Method:X-RAY DIFFRACTION (1.029 Å)
Cite:Synthesis, Racemic X-ray Crystallographic, and Permeability Studies of Bioactive Orbitides from Jatropha Species.
J. Nat. Prod., 81, 2018
6DL0
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BU of 6dl0 by Molmil
Crystal structure of pohlianin C, an orbitide from Jatropha pohliana
Descriptor: pohlianin C
Authors:Wang, C.K, King, G.J, Ramalho, S.D.
Deposit date:2018-05-31
Release date:2018-11-07
Last modified:2023-07-26
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Synthesis, Racemic X-ray Crystallographic, and Permeability Studies of Bioactive Orbitides from Jatropha Species.
J. Nat. Prod., 81, 2018
7RIJ
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BU of 7rij by Molmil
[I11G]hyen D
Descriptor: ACETATE ION, Cyclotide hyen-D, D-[I11L]hyen D
Authors:Du, Q, Huang, Y.H, Wang, C.K, Craik, D.J.
Deposit date:2021-07-20
Release date:2021-09-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Enabling efficient folding and high-resolution crystallographic analysis of bracelet cyclotides
Molecules, 26(18), 2021
7RIH
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BU of 7rih by Molmil
hyen D
Descriptor: CITRATE ANION, Cyclotide hyen-D, D-[I11L]hyen D
Authors:Du, Q, Huang, Y.H, Craik, D.J, Wang, C.K.
Deposit date:2021-07-20
Release date:2021-09-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Enabling efficient folding and high-resolution crystallographic analysis of bracelet cyclotides
Molecules, 26(18), 2021
7RII
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BU of 7rii by Molmil
[I11L]hyen D crystal structure
Descriptor: Cyclotide hyen-D, PHOSPHATE ION
Authors:Du, Q, Huang, Y.H, Craik, D.J, Wang, C.K.
Deposit date:2021-07-20
Release date:2021-09-29
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.22 Å)
Cite:Enabling efficient folding and high-resolution crystallographic analysis of bracelet cyclotides
Molecules, 26(18), 2021
4LRV
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BU of 4lrv by Molmil
Crystal structure of DndE from Escherichia coli B7A involved in DNA phosphorothioation modification
Descriptor: DNA sulfur modification protein DndE
Authors:Hu, W, Wang, C.K, Liang, J.D, Zhang, T.L, Yang, M, Hu, Z.P, Wang, Z.J, Lan, W.X, Wu, H.M, Ding, J.P, Wu, G, Deng, Z.X, Cao, C.
Deposit date:2013-07-21
Release date:2013-08-28
Last modified:2013-09-04
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural insights into DndE from Escherichia coli B7A involved in DNA phosphorothioation modification
Cell Res., 22, 2012
6U7X
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BU of 6u7x by Molmil
NMR solution structure of triazole bridged plasmin inhibitor
Descriptor: 1-methyl-1H-1,2,3-triazole, GLY-ARG-ALA-TYR-LYS-SER-LYS-PRO-PRO-ILE-ALA-PHE-PRO-ASP
Authors:White, A.M, Harvey, P.J, Wang, C.K, Durek, T, Craik, D.J.
Deposit date:2019-09-03
Release date:2020-04-22
Last modified:2020-07-15
Method:SOLUTION NMR
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
3S6S
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BU of 3s6s by Molmil
Ancylostoma-secreted protein Ac-ASP-7
Descriptor: Ac-ASP-7
Authors:Osman, A, Wang, C.K, Winter, A, Loukas, A, Tribolet, L, Gasser, R, Hofmann, A.
Deposit date:2011-05-26
Release date:2012-04-11
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Hookworm SCP/TAPS protein structure--A key to understanding host-parasite interactions and developing new interventions.
Biotechnol Adv, 30
3T82
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BU of 3t82 by Molmil
Human Carbonic Anhydrase II in complex with Acetylated Carbohydrate Sulfamates
Descriptor: 3,4-di-O-acetyl-6-O-sulfamoyl-alpha-D-glucopyranose, Carbonic anhydrase 2, ZINC ION
Authors:Hofmann, A, Wang, C.K.
Deposit date:2011-08-01
Release date:2011-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.002 Å)
Cite:Promiscuity of carbonic anhydrase II. Unexpected ester hydrolysis of carbohydrate-based sulfamate inhibitors.
J.Am.Chem.Soc., 133, 2011
3T84
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BU of 3t84 by Molmil
Human Carbonic Anhydrase II in complex with Acetylated Carbohydrate Sulfamates
Descriptor: 4-O-acetyl-6-O-sulfamoyl-alpha-D-galactopyranose, Carbonic anhydrase 2, ZINC ION
Authors:Hofmann, A, Wang, C.K.
Deposit date:2011-08-01
Release date:2011-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Promiscuity of carbonic anhydrase II. Unexpected ester hydrolysis of carbohydrate-based sulfamate inhibitors.
J.Am.Chem.Soc., 133, 2011
3T85
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BU of 3t85 by Molmil
Human Carbonic Anhydrase II in complex with Acetylated Carbohydrate Sulfamates
Descriptor: 3,4-di-O-acetyl-6-O-sulfamoyl-alpha-D-mannopyranose, Carbonic anhydrase 2, ZINC ION
Authors:Hofmann, A, Wang, C.K.
Deposit date:2011-08-01
Release date:2011-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Promiscuity of carbonic anhydrase II. Unexpected ester hydrolysis of carbohydrate-based sulfamate inhibitors.
J.Am.Chem.Soc., 133, 2011
3T83
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BU of 3t83 by Molmil
Human Carbonic Anhydrase II in complex with Acetylated Carbohydrate Sulfamates
Descriptor: 2,3,4-tri-O-propanoyl-6-O-sulfamoyl-alpha-D-glucopyranose, 2,3,4-tri-O-propanoyl-6-O-sulfamoyl-beta-D-glucopyranose, Carbonic anhydrase 2, ...
Authors:Hofmann, A, Wang, C.K.
Deposit date:2011-08-01
Release date:2011-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Promiscuity of carbonic anhydrase II. Unexpected ester hydrolysis of carbohydrate-based sulfamate inhibitors.
J.Am.Chem.Soc., 133, 2011

 

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