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1MOT
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BU of 1mot by Molmil
NMR Structure Of Extended Second Transmembrane Domain Of Glycine Receptor alpha1 Subunit in SDS Micelles
Descriptor: Glycine Receptor alpha-1 CHAIN
Authors:Yushmanov, V.E, Mandal, P.K, Liu, Z, Tang, P, Xu, Y.
Deposit date:2002-09-09
Release date:2003-09-23
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:NMR Structure and Backbone Dynamics of the Extended Second Transmembrane Domain of the Human Neuronal Glycine Receptor Alpha1 Subunit
Biochemistry, 42, 2003
9GES
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BU of 9ges by Molmil
Crystal structure of HEI10
Descriptor: E3 ubiquitin-protein ligase CCNB1IP1, ZINC ION
Authors:Milburn, A.E, Espejo-Serrano, C, Dunce, J.M, Davies, O.R.
Deposit date:2024-08-07
Release date:2025-08-20
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Crystal structure of HEI10
To Be Published
1M1L
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BU of 1m1l by Molmil
Human Suppressor of Fused (N-terminal domain)
Descriptor: Suppressor of Fused
Authors:Merchant, M, Vajdos, F.F, Ultsch, M, Maun, H.R, Wendt, U, Cannon, J, Lazarus, R.A, de Vos, A.M, de Sauvage, F.J.
Deposit date:2002-06-19
Release date:2004-02-03
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Suppressor of fused regulates Gli activity through a dual binding mechanism
Mol.Cell.Biol., 24, 2004
1M20
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BU of 1m20 by Molmil
Crystal Structure of F35Y Mutant of Trypsin-solubilized Fragment of Cytochrome b5
Descriptor: Cytochrome b5, PROTOPORPHYRIN IX CONTAINING FE
Authors:Yao, P, Wu, J, Wang, Y.-H, Sun, B.-Y, Xia, Z.-X, Huang, Z.-X.
Deposit date:2002-06-20
Release date:2002-09-11
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:X-ray crystallography, CD and kinetic studies revealed the essence of the abnormal behaviors of the cytochrome b5 Phe35-->Tyr mutant.
Eur.J.Biochem., 269, 2002
9GG8
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BU of 9gg8 by Molmil
Crystal structure of 14-3-3 sigma dC - C38N in complex with Tau pS214 peptide and covalent stabilizer 187
Descriptor: 14-3-3 protein sigma, 4-(3,4-dihydro-2~{H}-quinoxalin-1-ylsulfonyl)benzaldehyde, Microtubule-associated protein tau
Authors:van den Oetelaar, M.C.M, van de Wijngaart, T.R, Brunsveld, L, Ottmann, C.
Deposit date:2024-08-13
Release date:2025-08-27
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Modulation of Tau Condensation with 14-3-3/Tau Molecular Glues
To Be Published
1M25
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BU of 1m25 by Molmil
STRUCTURE OF SYNTHETIC 26-MER PEPTIDE CONTAINING 145-169 SHEEP PRION PROTEIN SEGMENT AND C-TERMINAL CYSTEINE IN TFE SOLUTION
Descriptor: MAJOR PRION PROTEIN
Authors:Megy, S, Bertho, G, Kozin, S.A, Coadou, G, Debey, P, Hoa, G.H, Girault, J.-P.
Deposit date:2002-06-21
Release date:2002-07-17
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Possible role of region 152-156 in the structural duality of a peptide fragment from sheep prion protein
Protein Sci., 13, 2004
9GE5
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BU of 9ge5 by Molmil
CryoEM structure of the human INO80-Hexasome complex
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Actin-related protein 5, ...
Authors:Sharma, M, Aggarwal, P, Hopfner, K.P.
Deposit date:2024-08-07
Release date:2025-08-20
Method:ELECTRON MICROSCOPY (3.35 Å)
Cite:Recognition and remodelling of nucleosomes and hexasomes by the human INO80 complex
To Be Published
1MNL
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BU of 1mnl by Molmil
HIGH-RESOLUTION SOLUTION STRUCTURE OF A SWEET PROTEIN SINGLE-CHAIN MONELLIN (SCM) DETERMINED BY NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY AND DYNAMICAL SIMULATED ANNEALING CALCULATIONS, 21 STRUCTURES
Descriptor: MONELLIN
Authors:Lee, S.-Y, Lee, J.-H, Chang, H.-J, Jo, J.-M, Jung, J.-W, Lee, W.
Deposit date:1998-08-06
Release date:1999-06-08
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure of a sweet protein single-chain monellin determined by nuclear magnetic resonance and dynamical simulated annealing calculations.
Biochemistry, 38, 1999
7SCF
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BU of 7scf by Molmil
M. tb EgtD in complex with HD2
Descriptor: (2S)-3-(1H-imidazol-5-yl)-2-(1H-pyrrol-1-yl)propanoic acid, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
Authors:Sudasinghe, T.D, Ronning, D.R.
Deposit date:2021-09-28
Release date:2021-12-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.67 Å)
Cite:Inhibitors of Mycobacterium tuberculosis EgtD target both substrate binding sites to limit hercynine production.
Sci Rep, 11, 2021
9GJZ
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BU of 9gjz by Molmil
Ntaya methyltransferase (MTase) bound to AT-9010 (2'-methyl-2'-fluoro GTP)
Descriptor: Genome polyprotein, S-ADENOSYL-L-HOMOCYSTEINE, [[(2R,3R,4R,5R)-5-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)-4-fluoranyl-4-methyl-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate
Authors:Boura, E, Krejcova, K.
Deposit date:2024-08-23
Release date:2025-09-03
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Ntaya methyltransferase (MTase) bound to AT-9010 (2'-methyl-2'-fluoro GTP)
To Be Published
1MP7
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BU of 1mp7 by Molmil
A Third Complex of Post-Activated Neocarzinostatin Chromophore with DNA. Bulge DNA Binding from the Minor Groove
Descriptor: 5'-D(*GP*CP*CP*AP*GP*AP*GP*AP*GP*C)-3', [(R)-4-((1,3-DIOXOLANE-2-OXY)-4-(S)-YL)-4-HYDROXY]-(R)-10-(2-METHYLAMINO-5-METHYL-2,6-DIDEOXYGALACTOPYRANOSYL-OXY)-(R)-11-(2-HYDROXY-5-METHYL-7-METHOXY-1-NAPHTHOYL-OXY)-(R)-12-S-GLUTATHIONYL-4,10,11,12-TETRAHYDROINDACENE
Authors:Kwon, Y, Xi, Z, Kappen, L.S, Goldberg, I.H, Gao, X.
Deposit date:2002-09-11
Release date:2003-02-18
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:New Complex of Post-Activated Neocarzinostatin Chromophore with DNA: Bulge DNA Binding from the Minor Groove
Biochemistry, 42, 2003
9GJY
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BU of 9gjy by Molmil
Bacillus licheniformis nitroreductase
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Crennell, S.J, Danson, M.J, Emptage, C.
Deposit date:2024-08-23
Release date:2025-09-03
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Structure of Bacillus licheniformis nitroreductase and analysis of prodrug specificity
To Be Published
1M2J
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BU of 1m2j by Molmil
Sir2 homologue H80N mutant-ADP ribose complex
Descriptor: ADENOSINE-5-DIPHOSPHORIBOSE, Silent Information Regulator 2, ZINC ION
Authors:Chang, J, Cho, Y.
Deposit date:2002-06-24
Release date:2003-04-08
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural basis for the NAD-dependent deacetylase mechanism of Sir2
J.BIOL.CHEM., 277, 2002
9GCE
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BU of 9gce by Molmil
Ang-1 domain of the HupE/UreJ-2 protein from Rhodobacteraceae bacterium RbAng-1a with Cu bound
Descriptor: COPPER (II) ION, Membrane protein, ZINC ION
Authors:Franco Cairo, J.P.L, Correa, T.L.R, Offen, W.A, Nairn, A, Walton, J, Davies, G.J, Walton, P.H, Sweeney, S.T.
Deposit date:2024-08-01
Release date:2025-09-10
Last modified:2025-10-29
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Signal-strapping as a protein-sequence search method for the discovery of metalloproteins.
Nat Commun, 16, 2025
1M2X
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BU of 1m2x by Molmil
Crystal Structure of the metallo-beta-lactamase BlaB of Chryseobacterium meningosepticum in complex with the inhibitor D-captopril
Descriptor: 1-(3-MERCAPTO-2-METHYL-PROPIONYL)-PYRROLIDINE-2-CARBOXYLIC ACID, GLYCEROL, SODIUM ION, ...
Authors:Garcia-Saez, I, Dideberg, O.
Deposit date:2002-06-26
Release date:2003-07-29
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The 1.5 A structure of Chryseobacterium meningosepticum Zn-beta-lactamase in complex with the inhibitor, D-captopril
J.Biol.Chem., 278, 2003
1M3A
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BU of 1m3a by Molmil
Solution structure of a circular form of the truncated N-terminal SH3 domain from oncogene protein c-Crk.
Descriptor: Proto-oncogene C-crk
Authors:Schumann, F.H, Varadan, R, Tayakuniyil, P.P, Hall, J.B, Camarero, J.A, Fushman, D.
Deposit date:2002-06-27
Release date:2003-08-05
Last modified:2024-10-09
Method:SOLUTION NMR
Cite:Changing protein backbone topology: Structural and dynamic consequences of the backbone cyclization in SH3 domain
To be Published
9GLD
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BU of 9gld by Molmil
NONO/SFPQ filament: local refinement central units (strand 2)
Descriptor: Non-POU domain containing octamer binding, Splicing factor proline/glutamine rich (polypyrimidine tract binding protein associated)
Authors:Rasmussen, T, Bottcher, B.
Deposit date:2024-08-27
Release date:2025-09-10
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:A filamentous scaffold for gene regulation
to be published
9GJQ
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BU of 9gjq by Molmil
Crystal structure of humanised cereblon from Magnetospirillum gryphiswaldense bound by dihydrouracil-indole compound [1-(1H-indol-6-yl)dihydro-2,4(1H,3H)-pyrimidinedione].
Descriptor: 1-(1H-indol-6-yl)-1,3-diazinane-2,4-dione, Cereblon isoform 4, ZINC ION
Authors:Collie, G.W.
Deposit date:2024-08-22
Release date:2025-09-03
Method:X-RAY DIFFRACTION (1.393 Å)
Cite:Discovery of dihydrouracil cereblon binders
To Be Published
1MQ5
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BU of 1mq5 by Molmil
Crystal Structure of 3-chloro-N-[4-chloro-2-[[(4-chlorophenyl)amino]carbonyl]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]-2-thiophenecarboxamide Complexed with Human Factor Xa
Descriptor: 3-CHLORO-N-[4-CHLORO-2-[[(4-CHLOROPHENYL)AMINO]CARBONYL]PHENYL]-4-[(4-METHYL-1-PIPERAZINYL)METHYL]-2-THIOPHENECARBOXAMIDE, CALCIUM ION, COAGULATION FACTOR X HEAVY CHAIN, ...
Authors:Adler, M, Whitlow, M.
Deposit date:2002-09-13
Release date:2003-01-28
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal Structures of Two Potent Nonamidine Inhibitors Bound to Factor Xa
Biochemistry, 41, 2002
1M3K
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BU of 1m3k by Molmil
biosynthetic thiolase, inactive C89A mutant
Descriptor: Acetyl-CoA acetyltransferase, GLYCEROL, SULFATE ION
Authors:Kursula, P, Ojala, J, Lambeir, A.-M, Wierenga, R.K.
Deposit date:2002-06-28
Release date:2002-11-29
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The catalytic cycle of biosynthetic thiolase: A conformational journey of an acetyl group through four binding modes and two oxyanion holes
Biochemistry, 41, 2002
1M47
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BU of 1m47 by Molmil
Crystal Structure of Human Interleukin-2
Descriptor: SULFATE ION, interleukin-2
Authors:Arkin, M.A, Randal, M, DeLano, W.L, Hyde, J, Luong, T.N, Oslob, J.D, Raphael, D.R, Taylor, L, Wang, J, Wells, J.A, McDowell, R.S, Wells, J.A, Braisted, A.C.
Deposit date:2002-07-02
Release date:2002-07-31
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Binding of small molecules to an adaptive protein-protein interface.
Proc.Natl.Acad.Sci.USA, 100, 2003
9GNF
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BU of 9gnf by Molmil
A novel aminotransferase from Streptomyces sp. Gabaculine complex
Descriptor: 1,2-ETHANEDIOL, 3-[O-PHOSPHONOPYRIDOXYL]--AMINO-BENZOIC ACID, CALCIUM ION, ...
Authors:De Rose, S.A, Isupov, M.N, Patti, S.
Deposit date:2024-09-02
Release date:2025-09-10
Method:X-RAY DIFFRACTION (1.31 Å)
Cite:a novel aminotransferase from Streptomyces sp.
To be Published
1M4C
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BU of 1m4c by Molmil
Crystal Structure of Human Interleukin-2
Descriptor: interleukin-2
Authors:Arkin, M.A, Randal, M, DeLano, W.L, Hyde, J, Luong, T.N, Oslob, J.D, Raphael, D.R, Taylor, L, Wang, J, McDowell, R.S, Wells, J.A, Braisted, A.C.
Deposit date:2002-07-02
Release date:2002-07-31
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Binding of small molecules to an adaptive protein-protein interface
Proc.Natl.Acad.Sci.USA, 100, 2003
9GP3
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BU of 9gp3 by Molmil
Crystal structure of CDK2-cyclin E1 bound by compound 11 (AZD8421)
Descriptor: (3~{S})-~{N}-ethyl-3-[[9-ethyl-2-[[(2~{R},3~{S})-2-oxidanylpentan-3-yl]amino]purin-6-yl]amino]pyrrolidine-1-sulfonamide, Cyclin-dependent kinase 2, G1/S-specific cyclin-E1
Authors:Collie, G.W, Pflug, A.
Deposit date:2024-09-06
Release date:2025-09-10
Last modified:2025-09-24
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Discovery of AZD8421: A Potent CDK2 Inhibitor with Selectivity Against Other CDK Family Members and the Human Kinome.
J.Med.Chem., 68, 2025
1MQJ
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BU of 1mqj by Molmil
Crystal structure of the GluR2 ligand binding core (S1S2J) in complex with willardiine at 1.65 angstroms resolution
Descriptor: 2-AMINO-3-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID, ZINC ION, glutamate receptor 2
Authors:Jin, R, Banke, T.G, Mayer, M.L, Traynelis, S.F, Gouaux, E.
Deposit date:2002-09-16
Release date:2003-08-05
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Structural basis for partial agonist action at ionotropic glutamate receptors
Nat.Neurosci., 6, 2003

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数据于2025-10-29公开中

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