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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
3S64
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BU of 3s64 by Molmil
Saposin-like protein Ac-SLP-1
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CITRIC ACID, Saposin-like protein 1
Authors:Willis, C, Wang, C.K, Osman, A, Simon, A, Mulvenna, J, Pickering, D, Riboldi-Tunicliffe, A, Jones, M.K, Loukas, A, Hofmann, A.
Deposit date:2011-05-25
Release date:2012-01-18
Method:X-RAY DIFFRACTION (2.301 Å)
Cite:Insights into the membrane interactions of the saposin-like proteins Na-SLP-1 and Ac-SLP-1 from human and dog hookworm.
Plos One, 6, 2011
3S6V
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BU of 3s6v by Molmil
Manganese-bound Ac-ASP-7
Descriptor: Ac-ASP-7, MANGANESE (II) ION
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
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Hookworm SCP/TAPS protein structure--A key to understanding host-parasite interactions and developing new interventions.
Biotechnol Adv, 30
3S63
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BU of 3s63 by Molmil
Saposin-like protein Na-SLP-1
Descriptor: Saposin-like protein
Authors:Willis, C, Wang, C.K, Osman, A, Simon, A, Mulvenna, J, Pickering, D, Riboldi-Tunicliffe, A, Jones, M.K, Loukas, A, Hofmann, A.
Deposit date:2011-05-24
Release date:2012-01-18
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Insights into the membrane interactions of the saposin-like proteins Na-SLP-1 and Ac-SLP-1 from human and dog hookworm.
Plos One, 6, 2011
3S6U
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BU of 3s6u by Molmil
Caclcium-bound Ac-ASP-7
Descriptor: Ac-ASP-7, CALCIUM ION
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
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Hookworm SCP/TAPS protein structure--A key to understanding host-parasite interactions and developing new interventions.
Biotechnol Adv, 30
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
2MN1
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BU of 2mn1 by Molmil
Solution Structure of kalata B1[W23WW]
Descriptor: kalata B1[W23WW]
Authors:Henriques, S.T, Huang, Y.H, Chaousis, S, Wang, C.K, Craik, D.J.
Deposit date:2014-03-26
Release date:2015-05-27
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Anticancer and toxic properties of cyclotides are dependent on phosphatidylethanolamine phospholipid targeting.
Chembiochem, 15, 2014
8D8O
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BU of 8d8o by Molmil
Cryo-EM structure of substrate unbound PAPP-A
Descriptor: Pappalysin-1, ZINC ION
Authors:Judge, R.A, Jain, R, Hao, Q, Ouch, C, Sridar, J, Smith, C.L, Wang, J.C.K, Eaton, D.
Deposit date:2022-06-08
Release date:2022-09-28
Method:ELECTRON MICROSCOPY (3.35 Å)
Cite:Structure of the PAPP-ABP5 complex reveals mechanism of substrate recognition
Nat Commun, 13, 2022
7UFG
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BU of 7ufg by Molmil
Cryo-EM structure of PAPP-A in complex with IGFBP5
Descriptor: Insulin-like growth factor-binding protein 5, Pappalysin-1, ZINC ION
Authors:Judge, R.A, Jain, R, Hao, Q, Ouch, C, Sridar, J, Smith, C.L, Wang, J.C.K, Eaton, D.
Deposit date:2022-03-22
Release date:2022-09-28
Last modified:2024-10-23
Method:ELECTRON MICROSCOPY (3.28 Å)
Cite:Structure of the PAPP-ABP5 complex reveals mechanism of substrate recognition
Nat Commun, 13, 2022
3E4H
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BU of 3e4h by Molmil
Crystal structure of the cyclotide varv F
Descriptor: Varv peptide F,Varv peptide F
Authors:Hu, S.H.
Deposit date:2008-08-11
Release date:2009-02-10
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.8 Å)
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
6U7U
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BU of 6u7u by Molmil
NMR solution structure of triazole bridged matriptase inhibitor
Descriptor: 1-methyl-1H-1,2,3-triazole, GLY-ARG-ALA-THR-LYS-SER-ILE-PRO-PRO-ARG-ALA-PHE-PRO-ASP
Authors:White, A.M, Harvey, P.J, Durek, T, Craik, D.J.
Deposit date:2019-09-03
Release date:2020-04-22
Last modified:2024-10-23
Method:SOLUTION NMR
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
6U7Q
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BU of 6u7q by Molmil
NMR solution structure of SFTI-R10
Descriptor: GLY-ARG-CYS-THR-LYS-SER-ILE-PRO-PRO-ARG-CYS-PHE-PRO-ASP inhibitor
Authors:White, A.M, Harvey, P.J, Durek, T, Craik, D.J.
Deposit date:2019-09-03
Release date:2020-04-22
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
6U24
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BU of 6u24 by Molmil
NMR solution structure of triazole bridged SFTI-1
Descriptor: 1-methyl-1H-1,2,3-triazole, GLY-ARG-ALA-THR-LYS-SER-ILE-PRO-PRO-ILE-ALA-PHE-PRO-ASP
Authors:White, A.M, Harvey, P.J, Durek, T, Craik, D.J.
Deposit date:2019-08-19
Release date:2020-07-01
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
6U7S
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BU of 6u7s by Molmil
NMR solution structure of SFTI-1 based plasmin inhibitor
Descriptor: GLY-ARG-CYS-TYR-LYS-SER-LYS-PRO-PRO-ILE-CYS-PHE-PRO-ASP inhibitor
Authors:White, A.M, Harvey, P.J, Durek, T, Craik, D.J.
Deposit date:2019-09-03
Release date:2020-04-22
Last modified:2024-10-23
Method:SOLUTION NMR
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
6U7W
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BU of 6u7w by Molmil
NMR solution structure of a triazole bridged KLK7 inhibitor
Descriptor: 1-methyl-1H-1,2,3-triazole, GLY-LYS-ALA-LEU-PHE-SER-ASN-PRO-PRO-ILE-ALA-PHE-PRO-ASN
Authors:White, A.M, Harvey, P.J, 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
6U22
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BU of 6u22 by Molmil
Crystal structure of SFTI-triazole inhibitor in complex with beta-trypsin
Descriptor: 1-methyl-1H-1,2,3-triazole, CALCIUM ION, Cationic trypsin, ...
Authors:White, A.M, King, G.J, Durek, T, Craik, D.J.
Deposit date:2019-08-19
Release date:2020-07-01
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
7RMR
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BU of 7rmr by Molmil
Crystal structure of [I11L]cycloviolacin O2
Descriptor: D-[I11L]cycloviolacin O2, THIOCYANATE ION, [I11L]cycloviolacin O2
Authors:Huang, Y.H, Du, Q, Craik, D.J.
Deposit date:2021-07-28
Release date:2021-09-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.04 Å)
Cite:Enabling Efficient Folding and High-Resolution Crystallographic Analysis of Bracelet Cyclotides.
Molecules, 26, 2021
7RMQ
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BU of 7rmq by Molmil
Crystal structure of cycloviolacin O2
Descriptor: Cycloviolacin O2, D-[I11L]cycloviolacin O2, FORMIC ACID
Authors:Huang, Y.H, Du, Q.
Deposit date:2021-07-28
Release date:2021-09-22
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.17 Å)
Cite:Enabling Efficient Folding and High-Resolution Crystallographic Analysis of Bracelet Cyclotides.
Molecules, 26, 2021
7RMS
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BU of 7rms by Molmil
Crystal structure of [I11G]cycloviolacin O2
Descriptor: D-[I11L]cycloviolacin O2, THIOCYANATE ION, [I11L]cycloviolacin O2
Authors:Huang, Y.H, Du, Q, Craik, D.J.
Deposit date:2021-07-28
Release date:2021-09-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Enabling Efficient Folding and High-Resolution Crystallographic Analysis of Bracelet Cyclotides.
Molecules, 26, 2021
7RJF
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BU of 7rjf by Molmil
MOPD-1 mutant-L47W
Descriptor: MALONATE ION, ZINC ION, [L47W]MOPD-1
Authors:Huawu, Y, Conan, K.W, Gordon, J.K, Brett, M.C, Yen-Hua, H, David, J.C.
Deposit date:2021-07-20
Release date:2021-10-27
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Rational Design of Potent Peptide Inhibitors of the PD-1:PD-L1 Interaction for Cancer Immunotherapy.
J.Am.Chem.Soc., 143, 2021
6Q1U
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BU of 6q1u by Molmil
Structure of plasmin and peptide complex
Descriptor: 1-methyl-1H-1,2,3-triazole, GLY-ARG-ALA-TYR-LYS-SER-LYS-PRO-PRO-ILE-ALA-PHE-PRO-ASP, Plasminogen
Authors:Wu, G, Law, R.H.P.
Deposit date:2019-08-06
Release date:2020-04-15
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.3467 Å)
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
8TYI
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BU of 8tyi by Molmil
NMR structure of L5pG ([p23W, G24W]kalata B1)
Descriptor: Kalata-B1
Authors:Tian, S, Craik, D.J, Conan, K.W.
Deposit date:2023-08-25
Release date:2024-03-13
Last modified:2024-10-30
Method:SOLUTION NMR
Cite:Nucleation of a key beta-turn promotes cyclotide oxidative folding.
J.Biol.Chem., 300, 2024
4EVH
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BU of 4evh by Molmil
Crystal structure of calcium-bound alpha-1 giardin
Descriptor: CALCIUM ION, Giardin subunit alpha-1
Authors:Weeratunga, S, Hofmann, A.
Deposit date:2012-04-26
Release date:2012-07-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Alpha-1 giardin is an annexin with highly unusual calcium-regulated mechanisms
J.Mol.Biol., 423, 2012
6U7R
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BU of 6u7r by Molmil
NMR solution structure of SFTI1 based KLK7 protease inhibitor
Descriptor: GLY-LYS-CYS-LEU-PHE-SER-ASN-PRO-PRO-ILE-CYS-PHE-PRO-ASN inhibitor
Authors:White, A.M, Harvey, P.J, Durek, T, Craik, D.J.
Deposit date:2019-09-03
Release date:2020-04-22
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Application and Structural Analysis of Triazole-Bridged Disulfide Mimetics in Cyclic Peptides.
Angew.Chem.Int.Ed.Engl., 59, 2020
4EVF
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BU of 4evf by Molmil
Crystal structure of apo alpha-1 giardin
Descriptor: Giardin subunit alpha-1
Authors:Weeratunga, S, Hofmann, A.
Deposit date:2012-04-26
Release date:2012-07-25
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Alpha-1 giardin is an annexin with highly unusual calcium-regulated mechanisms
J.Mol.Biol., 423, 2012

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