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1E0F
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BU of 1e0f by Molmil
Crystal structure of the human alpha-thrombin-haemadin complex: an exosite II-binding inhibitor
Descriptor: HAEMADIN, THROMBIN
Authors:Richardson, J.L, Kroeger, B, Hoefken, W, Pereira, P, Huber, R, Bode, W, Fuentes-Prior, P.
Deposit date:2000-03-27
Release date:2000-11-03
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Crystal Structure of the Human Alpha-Thrombin-Haemadin Complex: An Exosite II-Binding Inhibitor
Embo J., 19, 2000
1ABJ
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BU of 1abj by Molmil
STRUCTURE OF THE HIRULOG 3-THROMBIN COMPLEX AND NATURE OF THE S' SUBSITES OF SUBSTRATES AND INHIBITORS
Descriptor: ALPHA-THROMBIN (LARGE SUBUNIT), ALPHA-THROMBIN (SMALL SUBUNIT), D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide
Authors:Qiu, X, Tulinsky, A.
Deposit date:1992-08-24
Release date:1994-01-31
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure of the hirulog 3-thrombin complex and nature of the S' subsites of substrates and inhibitors.
Biochemistry, 31, 1992
1AE8
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BU of 1ae8 by Molmil
HUMAN ALPHA-THROMBIN INHIBITION BY EOC-D-PHE-PRO-AZALYS-ONP
Descriptor: 1-ETHOXYCARBONYL-D-PHE-PRO-2(4-AMINOBUTYL)HYDRAZINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, ALPHA-THROMBIN (LARGE SUBUNIT), ...
Authors:De Simone, G, Balliano, G, Milla, P, Gallina, C, Giordano, C, Tarricone, C, Rizzi, M, Bolognesi, M, Ascenzi, P.
Deposit date:1997-03-06
Release date:1997-12-03
Last modified:2023-08-02
Method:X-RAY DIFFRACTION (2 Å)
Cite:Human alpha-thrombin inhibition by the highly selective compounds N-ethoxycarbonyl-D-Phe-Pro-alpha-azaLys p-nitrophenyl ester and N-carbobenzoxy-Pro-alpha-azaLys p-nitrophenyl ester: a kinetic, thermodynamic and X-ray crystallographic study.
J.Mol.Biol., 269, 1997
1DIT
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BU of 1dit by Molmil
COMPLEX OF A DIVALENT INHIBITOR WITH THROMBIN
Descriptor: ALPHA-THROMBIN, PEPTIDE INHIBITOR CVS995
Authors:Tulinsky, A, Krishnan, R.
Deposit date:1995-07-20
Release date:1996-06-10
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Synthesis, structure, and structure-activity relationships of divalent thrombin inhibitors containing an alpha-keto-amide transition-state mimetic.
Protein Sci., 5, 1996
1DWE
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BU of 1dwe by Molmil
Crystallographic analysis at 3.0-Angstroms resolution of the binding to human thrombin of four active site-directed inhibitors
Descriptor: ALPHA-THROMBIN heavy chain, ALPHA-THROMBIN light chain, D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide, ...
Authors:Banner, D.W, Hadvary, P.
Deposit date:1992-08-19
Release date:1994-01-31
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystallographic analysis at 3.0-A resolution of the binding to human thrombin of four active site-directed inhibitors.
J.Biol.Chem., 266, 1991
9B17
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BU of 9b17 by Molmil
Crystal Structure of human Tryptophan 2,3-dioxygenase in complex with PAN1 inhibitor
Descriptor: (5P)-5-(1H-indol-3-yl)-1-[2-(piperazin-1-yl)ethyl]-1H-1,2,3-benzotriazole, PROTOPORPHYRIN IX CONTAINING FE, Tryptophan 2,3-dioxygenase, ...
Authors:Geeraerts, Z, Yeh, S.-R.
Deposit date:2024-03-13
Release date:2024-08-21
Last modified:2024-09-11
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Structural Insights into Protein-Inhibitor Interactions in Human Tryptophan Dioxygenase.
J.Med.Chem., 67, 2024
9B9I
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BU of 9b9i by Molmil
Myxococcus xanthus EncA encapsulin engineered pore mutant with T=1 icosahedral symmetry
Descriptor: Type 1 encapsulin shell protein EncA
Authors:Andreas, M.P, Kwon, S, Giessen, T.W.
Deposit date:2024-04-02
Release date:2024-09-18
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (2.86 Å)
Cite:Pore Engineering as a General Strategy to Improve Protein-Based Enzyme Nanoreactor Performance.
Acs Nano, 18, 2024
9EV5
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BU of 9ev5 by Molmil
Corynebacterium glutamicum CS176 pyruvate:quinone oxidoreductase (PQO) in complex with FAD and thiamine diphosphate-magnesium ion
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, MAGNESIUM ION, THIAMINE DIPHOSPHATE, ...
Authors:Da Silva Lameira, C, Muenssinger, S, Yang, L, Eikmanns, B.J, Bellinzoni, M.
Deposit date:2024-03-28
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.863 Å)
Cite:Corynebacterium glutamicum pyruvate:quinone oxidoreductase: an enigmatic metabolic enzyme with unusual structural features.
Febs J., 2024
9BC6
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BU of 9bc6 by Molmil
HCN1 M305L with propofol
Descriptor: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2,6-BIS(1-METHYLETHYL)PHENOL, Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 1
Authors:Kim, E.D, Nimigean, C.M.
Deposit date:2024-04-07
Release date:2024-07-31
Last modified:2024-08-21
Method:ELECTRON MICROSCOPY (2.5 Å)
Cite:Propofol rescues voltage-dependent gating of HCN1 channel epilepsy mutants.
Nature, 632, 2024
5E38
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BU of 5e38 by Molmil
Structural basis of mapping the spontaneous mutations with 5-flourouracil in uracil phosphoribosyltransferase from Mycobacterium tuberculosis
Descriptor: Uracil phosphoribosyltransferase
Authors:Ghode, P, Jobichen, C, Ramachandran, S, Bifani, P, Sivaraman, J.
Deposit date:2015-10-02
Release date:2015-10-21
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structural basis of mapping the spontaneous mutations with 5-flurouracil in uracil phosphoribosyltransferase from Mycobacterium tuberculosis
Biochem.Biophys.Res.Commun., 467, 2015
9AUS
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BU of 9aus by Molmil
Crystal structure of loop-closed dumbbell RNA bridged by glycine
Descriptor: Fab BL3-6 heavy chain, Fab BL3-6 light chain, GLYCINE, ...
Authors:Radakovic, A, Lewicka, A, Todisco, M, Aitken, H.R.M, Weiss, Z, Kim, S, Bannan, A, Piccirilli, J.A, Szostak, J.W.
Deposit date:2024-02-29
Release date:2024-09-04
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:A potential role for RNA aminoacylation prior to its role in peptide synthesis.
Proc.Natl.Acad.Sci.USA, 121, 2024
2BYJ
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BU of 2byj by Molmil
Ornithine aminotransferase mutant Y85I
Descriptor: ORNITHINE AMINOTRANSFERASE, PYRIDOXAL-5'-PHOSPHATE
Authors:Markova, M, Peneff, C, Hewlins, M.J.E, Schirmer, T, John, R.A.
Deposit date:2005-08-02
Release date:2005-09-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (3.02 Å)
Cite:Determinants of Substrate Specificity in Omega-Aminotransferases.
J.Biol.Chem., 280, 2005
9BC7
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BU of 9bc7 by Molmil
HCN1 M305L holo
Descriptor: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE, Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 1
Authors:Kim, E.D, Nimigean, C.M.
Deposit date:2024-04-08
Release date:2024-07-31
Last modified:2024-08-21
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Propofol rescues voltage-dependent gating of HCN1 channel epilepsy mutants.
Nature, 632, 2024
9EV4
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BU of 9ev4 by Molmil
Pyruvate:quinone oxidoreductase (PQO) from Corynebacterium glutamicum CS176
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Thiamine pyrophosphate-requiring enzymes [acetolactate synthase, pyruvate dehydrogenase (Cytochrome), ...
Authors:Da Silva Lameira, C, Muenssinger, S, Yang, L, Eikmanns, B.J, Bellinzoni, M.
Deposit date:2024-03-28
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.474 Å)
Cite:Corynebacterium glutamicum pyruvate:quinone oxidoreductase: an enigmatic metabolic enzyme with unusual structural features.
Febs J., 2024
2SFA
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BU of 2sfa by Molmil
SERINE PROTEINASE FROM STREPTOMYCES FRADIAE ATCC 14544
Descriptor: SERINE PROTEINASE
Authors:Kitadokoro, K, Tsuzuki, H.
Deposit date:1994-04-25
Release date:1996-06-20
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Purification, characterization, primary structure, crystallization and preliminary crystallographic study of a serine proteinase from Streptomyces fradiae ATCC 14544.
Eur.J.Biochem., 220, 1994
9AUR
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BU of 9aur by Molmil
Crystal structure of loop-closed A21 2'-OMe dumbbell RNA bridged by glycine
Descriptor: Fab BL3-6 heavy chain, Fab BL3-6 light chain, GLYCINE, ...
Authors:Radakovic, A, Lewicka, A, Todisco, M, Aitken, H.R.M, Weiss, Z, Kim, S, Bannan, A, Piccirilli, J.A, Szostak, J.W.
Deposit date:2024-02-29
Release date:2024-09-04
Last modified:2024-09-11
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:A potential role for RNA aminoacylation prior to its role in peptide synthesis.
Proc.Natl.Acad.Sci.USA, 121, 2024
9CYS
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BU of 9cys by Molmil
Toxin/immunity complex for a T6SS lipase effector from E. cloacae
Descriptor: Ankyrin repeat domain-containing protein, CITRIC ACID, GLYCEROL, ...
Authors:Cuthbert, B.J, Jensen, S.J, Goulding, C.W, Hayes, C.S.
Deposit date:2024-08-02
Release date:2024-08-14
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Advanced glycation end-product (AGE) crosslinking activates a type 6 secretion system phospholipase effector protein
Nature Communications, 2024
9EP9
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BU of 9ep9 by Molmil
NMR solution structure of lipid transfer protei Sola l7 from tomato seeds
Descriptor: Non-specific lipid-transfer protein
Authors:Parron-Ballesteros, J, Mantin-Pedraz, L, G.Gordo, R, Mayorga, C, Villaba, M, Batanero, E, Pantoja-Uceda, D, Turnay, J.
Deposit date:2024-03-18
Release date:2024-09-04
Method:SOLUTION NMR
Cite:Long-chain fatty acids block allergic reaction against lipid transfer protein Sola l 7 from tomato seeds.
Protein Sci., 33, 2024
2RDF
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BU of 2rdf by Molmil
Crystal Structure of staphyloccocal nuclease VIAGAN/E75A variant at cryogenic temperature
Descriptor: PHOSPHATE ION, Thermonuclease
Authors:Baran, K, Schlessman, J.L, Garcia-Moreno, B.E.
Deposit date:2007-09-22
Release date:2008-06-10
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Electrostatic effects in a network of polar and ionizable groups in staphylococcal nuclease.
J.Mol.Biol., 379, 2008
2RQ1
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BU of 2rq1 by Molmil
Solution structure of the 4.1R FERM alpha lobe domain
Descriptor: Protein 4.1
Authors:Kusunoki, H, Kohno, T.
Deposit date:2009-01-09
Release date:2009-04-14
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution structure and glycophorin C binding studies of the protein 4.1R FERM alpha-lobe domain
Proteins, 76, 2009
9AUE
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BU of 9aue by Molmil
Crystal structure of the holo form of GenB2 in complex with PMP
Descriptor: 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE, 6'-epimerase, C-6' aminotransferase, ...
Authors:Oliveira, G.S, Bury, P.S, Huang, F, Li, Y, Araujo, N.C, Zhou, J, Sun, Y, Leeper, F, Leadlay, P, Dias, M.V.B.
Deposit date:2024-02-29
Release date:2024-09-11
Method:X-RAY DIFFRACTION (1.46 Å)
Cite:Structural and Functional Basis of GenB2 Isomerase Activity from Gentamicin Biosynthesis.
Acs Chem.Biol., 2024
2C6K
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BU of 2c6k by Molmil
Crystal structure of the human CDK2 complexed with the triazolopyrimidine inhibitor
Descriptor: 4-{[5-(CYCLOHEXYLAMINO)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE, CELL DIVISION PROTEIN KINASE 2
Authors:Richardson, C.M, Dokurno, P, Murray, J.B, Surgenor, A.E.
Deposit date:2005-11-10
Release date:2005-12-07
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Triazolo[1,5-A]Pyrimidines as Novel Cdk2 Inhibitors: Protein Structure-Guided Design and Sar.
Bioorg.Med.Chem.Lett., 16, 2006
9FAA
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BU of 9faa by Molmil
Cryo-EM structure of cardiac collagen-associated amyloid AL59
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Monoclonal immunoglobulin light chains (LC)
Authors:Schulte, T, Speranzini, V, Chaves-Sanjuan, A, Milazzo, M, Ricagno, S.
Deposit date:2024-05-10
Release date:2024-07-17
Last modified:2024-08-14
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Helical superstructures between amyloid and collagen in cardiac fibrils from a patient with AL amyloidosis.
Nat Commun, 15, 2024
9B9Q
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BU of 9b9q by Molmil
Cargo-loaded Myxococcus xanthus EncA encapsulin engineered pore mutant with T=3 icosahedral symmetry
Descriptor: Encapsulin nanocompartment cargo protein EncC, Type 1 encapsulin shell protein EncA
Authors:Andreas, M.P, Kwon, S, Giessen, T.W.
Deposit date:2024-04-03
Release date:2024-09-18
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (3.14 Å)
Cite:Pore Engineering as a General Strategy to Improve Protein-Based Enzyme Nanoreactor Performance.
Acs Nano, 18, 2024
9B0C
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BU of 9b0c by Molmil
Crystal structure of GenB2 in complex with gentamicin X2.
Descriptor: (1R,2S,3S,4R,6S)-4,6-diamino-3-{[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl]oxy}-2-hydroxycyclohexyl 2-amino-2-deoxy-alpha-D-glucopyranoside, 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE, 6'-epimerase, ...
Authors:Bury, P.S, Araujo, N.C, Oliveira, G.S, Dias, M.V.B.
Deposit date:2024-03-11
Release date:2024-09-11
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Structural and Functional Basis of GenB2 Isomerase Activity from Gentamicin Biosynthesis.
Acs Chem.Biol., 2024

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数据于2024-09-25公开中

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