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7DA6
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BU of 7da6 by Molmil
Enterovirus 71 2A Protease mutant- C110A in complex with peptide inhibitor
Descriptor: PHE-ARG-GLY-LYS, Polyprotein, ZINC ION
Authors:Yang, W.Z, Yuan, H.S.
Deposit date:2020-10-15
Release date:2021-08-25
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Efficient Strategy to Design Protease Inhibitors: Application to Enterovirus 71 2A Protease.
Acs Bio Med Chem Au, 2022
7SEU
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BU of 7seu by Molmil
Crystal structure of E coli contaminant protein YncE co-purified with a plant protein
Descriptor: PQQ-dependent catabolism-associated beta-propeller protein
Authors:Chai, L, Zhu, P, Chai, J, Pang, C, Andi, B, McsWeeney, S, Shanklin, J, Liu, Q.
Deposit date:2021-10-01
Release date:2022-04-20
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:AlphaFold Protein Structure Database for Sequence-Independent Molecular Replacement
Crystals, 11, 2021
2RFB
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BU of 2rfb by Molmil
Crystal Structure of a Cytochrome P450 from the Thermoacidophilic Archaeon Picrophilus Torridus
Descriptor: Cytochrome P450, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION
Authors:Ho, W.W, Li, H, Poulos, T.L, Nishida, C.R, Ortiz de Montellano, P.R.
Deposit date:2007-09-28
Release date:2008-01-29
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal Structure and Properties of CYP231A2 from the Thermoacidophilic Archaeon Picrophilus torridus.
Biochemistry, 47, 2008
2GEB
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BU of 2geb by Molmil
Crystal structure of the Thermoanaerobacter tengcongensis hypoxanthine-guanine phosphoribosyltransferase L160I mutant: insights into the inhibitor design
Descriptor: CALCIUM ION, Hypoxanthine-guanine phosphoribosyltransferase
Authors:Chen, Q, Luo, M.
Deposit date:2006-03-19
Release date:2007-04-03
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal structure of Thermoanaerobacter tengcongensis hypoxanthine-guanine phosphoribosyl transferase L160I mutant--insights into inhibitor design.
Febs J., 274, 2007
2ROV
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BU of 2rov by Molmil
The split PH domain of ROCK II
Descriptor: Rho-associated protein kinase 2
Authors:Wen, W, Zhang, M.
Deposit date:2008-04-25
Release date:2008-06-24
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:The split PH domain of ROCK II
To be Published
5IMT
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BU of 5imt by Molmil
Toxin receptor complex
Descriptor: CD59 glycoprotein, COPPER (II) ION, Intermedilysin, ...
Authors:Morton, C.J, Lawrence, S.L, Feil, S.C, Parker, M.W.
Deposit date:2016-03-06
Release date:2016-08-24
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.7001 Å)
Cite:Structural Basis for Receptor Recognition by the Human CD59-Responsive Cholesterol-Dependent Cytolysins.
Structure, 24, 2016
2GA7
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BU of 2ga7 by Molmil
Solution structure of the copper(I) form of the third metal-binding domain of ATP7A protein (menkes disease protein)
Descriptor: COPPER (I) ION, Copper-transporting ATPase 1
Authors:Banci, L, Bertini, I, Cantini, F, DellaMalva, N, Rosato, A, Herrmann, T, Wuthrich, K, Structural Proteomics in Europe (SPINE)
Deposit date:2006-03-08
Release date:2006-08-01
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution structure and intermolecular interactions of the third metal-binding domain of ATP7A, the Menkes disease protein.
J.Biol.Chem., 281, 2006
2RPS
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BU of 2rps by Molmil
Solution structure of a novel insect chemokine isolated from integument
Descriptor: Chemokine
Authors:Kamiya, M, Nakatogawa, S, Oda, Y, Kamijima, T, Aizawa, T, Demura, M, Hayakawa, Y, Kawano, K.
Deposit date:2008-07-28
Release date:2009-06-16
Last modified:2022-03-16
Method:SOLUTION NMR
Cite:A novel peptide mediates aggregation and migration of hemocytes from an insect
Curr.Biol., 19, 2009
2RPV
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BU of 2rpv by Molmil
Solution Structure of GB1 with LBT probe
Descriptor: Immunoglobulin G-binding protein G, LANTHANUM (III) ION
Authors:Saio, T, Ogura, K, Yokochi, M, Kobashigawa, Y, Inagaki, F.
Deposit date:2008-10-28
Release date:2009-09-15
Last modified:2021-11-10
Method:SOLUTION NMR
Cite:Two-point anchoring of a lanthanide-binding peptide to a target protein enhances the paramagnetic anisotropic effect
J.Biomol.Nmr, 44, 2009
5IN4
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BU of 5in4 by Molmil
Crystal Structure of GDP-mannose 4,6 dehydratase bound to a GDP-fucose based inhibitor
Descriptor: GDP-mannose 4,6 dehydratase, GUANOSINE-5'-DIPHOSPHATE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Sickmier, E.A.
Deposit date:2016-03-07
Release date:2016-08-17
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Facile Modulation of Antibody Fucosylation with Small Molecule Fucostatin Inhibitors and Cocrystal Structure with GDP-Mannose 4,6-Dehydratase.
Acs Chem.Biol., 11, 2016
2GFU
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BU of 2gfu by Molmil
NMR solution structure of the PWWP domain of Mismatch repair protein hMSH6
Descriptor: DNA mismatch repair protein MSH6
Authors:Laguri, C, Friedrich, N, Axt, M, Gilquin, B, Zinn-Justin, S, Couprie, J.
Deposit date:2006-03-23
Release date:2007-04-10
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:The PWWP domain of Mismatch Repair protein hMSH6 is involved in double stranded and single stranded DNA binding
To be Published
2RQA
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BU of 2rqa by Molmil
Solution structure of LGP2 CTD
Descriptor: ATP-dependent RNA helicase DHX58, ZINC ION
Authors:Takahasi, K, Kumeta, H, Tsuduki, N, Narita, R, Shigemoto, T, Hirai, R, Yoneyama, M, Horiuchi, M, Ogura, K, Fujita, T, Fuyuhiko, I.
Deposit date:2009-03-17
Release date:2009-05-05
Last modified:2022-03-16
Method:SOLUTION NMR
Cite:Solution Structures of Cytosolic RNA Sensor MDA5 and LGP2 C-terminal Domains: IDENTIFICATION OF THE RNA RECOGNITION LOOP IN RIG-I-LIKE RECEPTORS
J.Biol.Chem., 284, 2009
7S76
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BU of 7s76 by Molmil
HBV CAPSID Y132A WITH COMPOUND 10b AT 2.5A RESOLUTION
Descriptor: (1-methyl-1H-1,2,4-triazol-3-yl)methyl {(4S)-1-[(3-chloro-4-fluorophenyl)carbamoyl]-2-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-4-yl}carbamate, Capsid protein
Authors:Olland, A.M, Suto, R.K.
Deposit date:2021-09-15
Release date:2022-05-04
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The identification of highly efficacious functionalised tetrahydrocyclopenta[ c ]pyrroles as inhibitors of HBV viral replication through modulation of HBV capsid assembly.
Rsc Med Chem, 13, 2022
2RQU
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BU of 2rqu by Molmil
Solution structure of the complex between the DDEF1 SH3 domain and the APC SAMP1 motif
Descriptor: 19-mer from Adenomatous polyposis coli protein, DDEF1_SH3
Authors:Kaieda, S, Matsui, C, Mimori-Kiyosue, Y, Ikegami, T.
Deposit date:2009-12-14
Release date:2010-07-07
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Structural basis of the recognition of the SAMP motif of adenomatous polyposis coli by the Src-homology 3 domain.
Biochemistry, 49, 2010
5IO6
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BU of 5io6 by Molmil
Bovine beta-lactoglobulin complex with dodecane, ambient pressure
Descriptor: DODECANE, Major allergen beta-lactoglobulin
Authors:Kurpiewska, K, Biela, A.
Deposit date:2016-03-08
Release date:2016-03-16
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.851 Å)
Cite:Investigation of high pressure effect on the structure and adsorption of beta-lactoglobulin.
Colloids Surf B Biointerfaces, 161, 2017
2GDF
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BU of 2gdf by Molmil
Crystal structure of Dioclea violacea seed lectin
Descriptor: CALCIUM ION, MANGANESE (II) ION, lectin
Authors:Gallego del Sol, F, Chornet, J.J.C, Cavada, B.S.
Deposit date:2006-03-16
Release date:2006-09-16
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of Dioclea violacea seed lectin
To be published
2GHW
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BU of 2ghw by Molmil
Crystal structure of SARS spike protein receptor binding domain in complex with a neutralizing antibody, 80R
Descriptor: CHLORIDE ION, Spike glycoprotein, anti-sars scFv antibody, ...
Authors:Hwang, W.C, Lin, Y, Santelli, E, Sui, J, Jaroszewski, L, Stec, B, Farzan, M, Marasco, W.A, Liddington, R.C.
Deposit date:2006-03-27
Release date:2006-09-19
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis of neutralization by a human anti-severe acute respiratory syndrome spike protein antibody, 80R.
J.Biol.Chem., 281, 2006
2GDO
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BU of 2gdo by Molmil
4-(Aminoalkylamino)-3-Benzimidazole-Quinolinones As Potent CHK1 Inhibitors
Descriptor: 4-[(3S)-1-AZABICYCLO[2.2.2]OCT-3-YLAMINO]-3-(1H-BENZIMIDAZOL-2-YL)-6-CHLOROQUINOLIN-2(1H)-ONE, SULFATE ION, Serine/threonine-protein kinase Chk1
Authors:Le, V, Dove, J, Fang, E, Bussiere, D.E.
Deposit date:2006-03-16
Release date:2007-03-20
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (3 Å)
Cite:4-(Aminoalkylamino)-3-benzimidazole-quinolinones as potent CHK-1 inhibitors.
Bioorg.Med.Chem.Lett., 16, 2006
7S4A
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BU of 7s4a by Molmil
MRG15 complex with PALB2 peptide
Descriptor: Mortality factor 4-like protein 1, Partner and localizer of BRCA2
Authors:Korolev, S, Deveryshetty, J.
Deposit date:2021-09-08
Release date:2022-05-04
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.693 Å)
Cite:Structural Insight into the Mechanism of PALB2 Interaction with MRG15.
Genes (Basel), 12, 2021
2G7U
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BU of 2g7u by Molmil
2.3 A structure of putative catechol degradative operon regulator from Rhodococcus sp. RHA1
Descriptor: transcriptional regulator
Authors:Zheng, H, Skarina, T, Chruszcz, M, Cymborowski, M, Grabowski, M, Onopriyenko, O, Savchenko, A, Edwards, A, Joachimiak, A, Minor, W, Midwest Center for Structural Genomics (MCSG)
Deposit date:2006-03-01
Release date:2006-04-04
Last modified:2022-04-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:2.3 A structure of putative catechol degradative operon regulator from Rhodococcus sp. RHA1
To be Published
5I11
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BU of 5i11 by Molmil
Crystal structure of the intertwined form of the Src tyrosine kinase SH3 domain T114S-Q128R mutant
Descriptor: ACETATE ION, DI(HYDROXYETHYL)ETHER, Proto-oncogene tyrosine-protein kinase Src, ...
Authors:Camara-Artigas, A.
Deposit date:2016-02-05
Release date:2016-03-09
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal structure of the intertwined form of the Src tyrosine kinase SH3 domain T114S-Q128R mutant
To Be Published
7DFY
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BU of 7dfy by Molmil
Novel motif for left-handed G-quadruplex formation
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 2xMotif2, POTASSIUM ION, ...
Authors:Das, P, Winnerdy, F.R, Maity, A, Mechulam, Y, Phan, A.T.
Deposit date:2020-11-10
Release date:2021-09-01
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:A novel minimal motif for left-handed G-quadruplex formation.
Chem.Commun.(Camb.), 57, 2021
2GDY
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BU of 2gdy by Molmil
Solution structure of the B. brevis TycC3-PCP in A-state
Descriptor: Tyrocidine synthetase III
Authors:Koglin, A, Loehr, F, Rogov, V.V, Marahiel, M.A, Bernhard, F, Doetsch, V.
Deposit date:2006-03-17
Release date:2006-08-01
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Conformational switches modulate protein interactions in peptide antibiotic synthetases
Science, 312, 2006
7SJJ
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BU of 7sjj by Molmil
Crystal structure of photoactive yellow protein (PYP); F96oCNF construct
Descriptor: 4'-HYDROXYCINNAMIC ACID, Photoactive yellow protein
Authors:Weaver, J.B, Kirsh, J.M, Boxer, S.G.
Deposit date:2021-10-17
Release date:2022-05-11
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Nitrile Infrared Intensities Characterize Electric Fields and Hydrogen Bonding in Protic, Aprotic, and Protein Environments.
J.Am.Chem.Soc., 144, 2022
7RY1
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BU of 7ry1 by Molmil
human Hsp90_MC domain structure
Descriptor: Heat shock protein HSP 90-alpha, N-[2-(1-MALEIMIDYL)ETHYL]-7-DIETHYLAMINOCOUMARIN-3-CARBOXAMIDE
Authors:Peng, S, Deng, J, Matts, R.
Deposit date:2021-08-24
Release date:2022-05-11
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.523 Å)
Cite:Crystal structure of the middle and C-terminal domains of Hsp90 alpha labeled with a coumarin derivative reveals a potential allosteric binding site as a drug target.
Acta Crystallogr D Struct Biol, 78, 2022

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數據於2024-07-17公開中

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