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PDB: 42550 results

4M0F
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BU of 4m0f by Molmil
Structure of human acetylcholinesterase in complex with territrem B
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Cheung, J, Gary, E.N, Shiomi, K, Rosenberry, T.L.
Deposit date:2013-08-01
Release date:2013-10-16
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.304 Å)
Cite:Structures of human acetylcholinesterase bound to dihydrotanshinone I and territrem B show peripheral site flexibility.
ACS Med Chem Lett, 4, 2013
3IJ3
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BU of 3ij3 by Molmil
1.8 Angstrom Resolution Crystal Structure of Cytosol Aminopeptidase from Coxiella burnetii
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Cytosol aminopeptidase, ...
Authors:Minasov, G, Halavaty, A, Shuvalova, L, Dubrovska, I, Winsor, J, Papazisi, L, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2009-08-03
Release date:2009-08-11
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:1.8 Angstrom Resolution Crystal Structure of Cytosol Aminopeptidase from Coxiella burnetii
TO BE PUBLISHED
3V7K
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BU of 3v7k by Molmil
Co-crystal structure of K72E variant of rat polymerase beta: Enzyme-DNA binary complex
Descriptor: DNA (5'-D(P*AP*TP*GP*TP*GP*AP*GP*T)-3'), DNA (5'-D(P*CP*AP*AP*AP*CP*TP*CP*AP*CP*AP*A)-3'), DNA polymerase beta, ...
Authors:Rangarajan, S, Jaeger, J.
Deposit date:2011-12-21
Release date:2013-01-16
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.271 Å)
Cite:Crystallographic studies of K72E mutant DNA polymerase explain loss of lyase function and reveal changes in the overall conformational state of the polymerase domain
To be Published
3VAS
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BU of 3vas by Molmil
Adenosine kinase from Schistosoma mansoni in complex with adenosine in occluded loop conformation
Descriptor: ADENOSINE, CHLORIDE ION, Putative adenosine kinase
Authors:Romanello, L, Bachega, F.R, Garatt, R.C, DeMarco, R, Brandao-neto, J, Pereira, H.M.
Deposit date:2011-12-29
Release date:2012-11-14
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Adenosine kinase from Schistosoma mansoni: structural basis for the differential incorporation of nucleoside analogues.
Acta Crystallogr.,Sect.D, 69, 2013
7PK5
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BU of 7pk5 by Molmil
Phosphodiesterase PdeL (EAL domain of crystals comprising full-length protein)
Descriptor: Cyclic di-GMP phosphodiesterase PdeL
Authors:Fadel, J, Schirmer, T.
Deposit date:2021-08-25
Release date:2022-09-07
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (4.4 Å)
Cite:Phosphodiesterase PdeL (EAL domain of crystals comprising full-length protein)
To Be Published
3VBY
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BU of 3vby by Molmil
Exploitation of hydrogen bonding constraints and flat hydrophobic energy landscapes in Pim-1 kinase needle screening and inhibitor design
Descriptor: IMIDAZOLE, Serine/threonine-protein kinase pim-1, furan-2-yl(1H-indol-3-yl)methanone
Authors:Liu, J.
Deposit date:2012-01-02
Release date:2012-03-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Implications of promiscuous Pim-1 kinase fragment inhibitor hydrophobic interactions for fragment-based drug design.
J.Med.Chem., 55, 2012
3IGF
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BU of 3igf by Molmil
Crystal Structure of the All4481 protein from Nostoc sp. PCC 7120, Northeast Structural Genomics Consortium Target NsR300
Descriptor: All4481 protein
Authors:Forouhar, F, Abashidze, M, Seetharaman, J, Mao, M, Xiao, R, Ciccosanti, C, Maglaqui, M, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG)
Deposit date:2009-07-27
Release date:2009-08-04
Last modified:2023-05-10
Method:X-RAY DIFFRACTION (2 Å)
Cite:Northeast Structural Genomics Consortium Target NsR300
To be Published
3VAP
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BU of 3vap by Molmil
Synthesis and SAR Studies of imidazo-[1,2-a]-pyrazine Aurora kinase inhibitors with improved off target kinase selectivity
Descriptor: 3-(1-{2-[(3-fluoropyridinium-4-yl)amino]-2-oxoethyl}-1H-pyrazol-4-yl)-6-methyl-8-[(3-{[(1R,3R)-3-methylpiperidinium-1-yl]methyl}-1,2-thiazol-5-yl)amino]imidazo[1,2-a]pyrazin-1-ium, Aurora kinase A
Authors:Voss, M.E, Rainka, M.P, Fleming, M, Peterson, L.H, Belanger, D.B, Siddiqui, M.A, Hruza, A, Voigt, J, Basso, A.D, Gray, K.
Deposit date:2011-12-29
Release date:2012-05-02
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.66 Å)
Cite:Synthesis and SAR studies of imidazo-[1,2-a]-pyrazine Aurora kinase inhibitors with improved off-target kinase selectivity.
Bioorg.Med.Chem.Lett., 22, 2012
3IR9
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BU of 3ir9 by Molmil
C-terminal domain of Peptide Chain Release Factor from Methanosarcina mazei.
Descriptor: Peptide chain release factor subunit 1, ZINC ION
Authors:Osipiuk, J, Rakowski, E, Freeman, L, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-08-21
Release date:2009-09-01
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2.207 Å)
Cite:X-ray crystal structure of C-terminal domain of Peptide Chain Release Factor from Methanosarcina mazei.
To be Published
1OS5
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BU of 1os5 by Molmil
Crystal structure of HCV NS5B RNA polymerase complexed with a novel non-competitive inhibitor.
Descriptor: 3-(4-AMINO-2-TERT-BUTYL-5-METHYL-PHENYLSULFANYL)-6-CYCLOPENTYL-4-HYDROXY-6-[2-(4-HYDROXY-PHENYL)-ETHYL]-5,6-DIHYDRO-PYRAN-2-ONE, Hepatitis C virus NS5B RNA polymerase
Authors:Love, R.A, Parge, H.E, Yu, X, Hickey, M.J, Diehl, W, Gao, J, Wriggers, H, Ekker, A, Wang, L, Thomson, J.A, Dragovich, P.S, Fuhrman, S.A.
Deposit date:2003-03-18
Release date:2004-03-18
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystallographic identification of a noncompetitive inhibitor binding site on the hepatitis C virus NS5B RNA polymerase enzyme.
J.Virol., 77, 2003
1RUN
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BU of 1run by Molmil
CATABOLITE GENE ACTIVATOR PROTEIN (CAP)/DNA COMPLEX + ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE
Descriptor: ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE, DNA (5'-D(*CP*TP*AP*GP*AP*TP*CP*AP*CP*AP*TP*TP*TP*TP*TP*CP*G )-3'), DNA (5'-D(*GP*CP*GP*AP*AP*AP*AP*AP*TP*GP*TP*GP*AP*T)-3'), ...
Authors:Parkinson, G.N, Gunasekera, A, Vojtechovsky, J, Zhang, X, Kunkel, T.A, Berman, H.M, Ebright, R.H.
Deposit date:1996-05-26
Release date:1997-01-10
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Aromatic hydrogen bond in sequence-specific protein DNA recognition.
Nat.Struct.Biol., 3, 1996
3IT5
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BU of 3it5 by Molmil
Crystal Structure of the LasA Virulence Factor from Pseudomonas aeruginosa
Descriptor: Protease lasA, ZINC ION
Authors:Spencer, J, Murphy, L.M, Conners, R, Sessions, R.B, Gamblin, S.J.
Deposit date:2009-08-27
Release date:2009-11-17
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of the LasA virulence factor from Pseudomonas aeruginosa: substrate specificity and mechanism of M23 metallopeptidases.
J.Mol.Biol., 396, 2010
3ILX
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BU of 3ilx by Molmil
Crystal structure of First ORF in transposon ISC1904 from Sulfolobus solfataricus P2
Descriptor: First ORF in transposon ISC1904, GLYCEROL
Authors:Chang, C, Bigelow, L, Bearden, J, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-08-07
Release date:2009-08-25
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of First ORF in transposon ISC1904 from Sulfolobus solfataricus P2
To be Published
3IWG
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BU of 3iwg by Molmil
Acetyltransferase from GNAT family from Colwellia psychrerythraea.
Descriptor: Acetyltransferase, GNAT family, CHLORIDE ION, ...
Authors:Osipiuk, J, Stein, A, Shackelford, G, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-09-02
Release date:2009-09-15
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:X-ray crystal structure of Acetyltransferase from GNAT family from Colwellia psychrerythraea.
To be Published
3IXF
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BU of 3ixf by Molmil
Crystal Structure of Dehaloperoxidase B at 1.58 and Structural Characterization of the AB Dimer from Amphitrite ornata
Descriptor: Dehaloperoxidase B, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:de Serrano, V.S, D'Antonio, J, Thompson, M.K, Franzen, S, Ghiladi, R.A.
Deposit date:2009-09-03
Release date:2010-05-19
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Structure of dehaloperoxidase B at 1.58 A resolution and structural characterization of the AB dimer from Amphitrite ornata.
Acta Crystallogr.,Sect.D, 66, 2010
1R1G
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BU of 1r1g by Molmil
Crystal Structure of the Scorpion Toxin BmBKTtx1
Descriptor: Neurotoxin BmK37
Authors:Szyk, A, Lu, W, Xu, C, Lubkowski, J.
Deposit date:2003-09-23
Release date:2004-03-02
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Structure of the scorpion toxin BmBKTtx1 solved from single wavelength anomalous scattering of sulfur.
J.Struct.Biol., 145, 2004
4LOG
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BU of 4log by Molmil
The crystal structure of the orphan nuclear receptor PNR ligand binding domain fused with MBP
Descriptor: Maltose ABC transporter periplasmic protein and NR2E3 protein chimeric construct
Authors:Tan, M.E, Zhou, X.E, Soon, F.-F, Li, X, Li, J, Yong, E.-L, Melcher, K, Xu, H.E.
Deposit date:2013-07-12
Release date:2013-10-09
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:The Crystal Structure of the Orphan Nuclear Receptor NR2E3/PNR Ligand Binding Domain Reveals a Dimeric Auto-Repressed Conformation.
Plos One, 8, 2013
3VOY
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BU of 3voy by Molmil
Crystal structure of human glutaminase in apo form
Descriptor: Glutaminase kidney isoform, mitochondrial, SULFATE ION
Authors:Thangavelu, K, Sivaraman, J.
Deposit date:2012-02-23
Release date:2012-06-13
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural basis for the allosteric inhibitory mechanism of human kidney-type glutaminase (KGA) and its regulation by Raf-Mek-Erk signaling in cancer cell metabolism.
Proc.Natl.Acad.Sci.USA, 109, 2012
3VU1
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BU of 3vu1 by Molmil
Crystal structure of the C-terminal globular domain of oligosaccharyltransferase (PhAglB-L, O74088_PYRHO) from Pyrococcus horikoshii
Descriptor: CALCIUM ION, CHLORIDE ION, Putative uncharacterized protein PH0242
Authors:Nyirenda, J, Matsumoto, S, Saitoh, T, Maita, N, Noda, N.N, Inagaki, F, Kohda, D.
Deposit date:2012-06-13
Release date:2013-01-23
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystallographic and NMR Evidence for Flexibility in Oligosaccharyltransferases and Its Catalytic Significance
Structure, 21, 2013
3I8T
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BU of 3i8t by Molmil
N-terminal CRD1 domain of mouse Galectin-4 in complex with lactose
Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, Galectin-4, ...
Authors:Brynda, J, Krejcirikova, V, Rezacova, P.
Deposit date:2009-07-10
Release date:2011-02-23
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structure of the mouse galectin-4 N-terminal carbohydrate-recognition domain reveals the mechanism of oligosaccharide recognition
Acta Crystallogr.,Sect.D, 67, 2011
3IBF
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BU of 3ibf by Molmil
Crystal structure of unliganded caspase-7
Descriptor: Caspase-7
Authors:Agniswamy, J.
Deposit date:2009-07-15
Release date:2009-09-01
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Conformational similarity in the activation of caspase-3 and -7 revealed by the unliganded and inhibited structures of caspase-7.
Apoptosis, 14, 2009
3IA1
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BU of 3ia1 by Molmil
Crystal structure of thio-disulfide isomerase from Thermus thermophilus
Descriptor: ACETATE ION, Thio-disulfide isomerase/thioredoxin
Authors:Patskovsky, Y, Toro, R, Freeman, J, Chang, S, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2009-07-13
Release date:2009-07-21
Last modified:2021-10-13
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Crystal structure of thio-disulfide isomerase from Thermus thermophilus
To be Published
3VQZ
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BU of 3vqz by Molmil
Crystal structure of metallo-beta-lactamase, SMB-1, in a complex with mercaptoacetic acid
Descriptor: Metallo-beta-lactamase, SODIUM ION, SULFANYLACETIC ACID, ...
Authors:Wachino, J, Yamaguchi, Y, Mori, S, Arakawa, Y, Shibayama, K.
Deposit date:2012-04-02
Release date:2013-02-13
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural Insights into the Subclass B3 Metallo-beta-Lactamase SMB-1 and the Mode of Inhibition by the Common Metallo- -Lactamase Inhibitor Mercaptoacetate
Antimicrob.Agents Chemother., 57, 2013
3IBR
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BU of 3ibr by Molmil
Crystal Structure of P. aeruginosa Bacteriophytochrome Photosensory Core Module Mutant Q188L in the Mixed Pr/Pfr State
Descriptor: BILIVERDINE IX ALPHA, Bacteriophytochrome
Authors:Yang, X, Kuk, J, Moffat, K.
Deposit date:2009-07-16
Release date:2009-09-22
Last modified:2021-10-13
Method:X-RAY DIFFRACTION (2.97 Å)
Cite:Conformational differences between the Pfr and Pr states in Pseudomonas aeruginosa bacteriophytochrome.
Proc.Natl.Acad.Sci.USA, 106, 2009
1R7R
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BU of 1r7r by Molmil
The crystal structure of murine p97/VCP at 3.6A
Descriptor: ADENOSINE-5'-DIPHOSPHATE, Transitional endoplasmic reticulum ATPase
Authors:Huyton, T, Pye, V.E, Briggs, L.C, Flynn, T.C, Beuron, F, Kondo, H, Ma, J, Zhang, X, Freemont, P.S.
Deposit date:2003-10-22
Release date:2003-12-16
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (3.6 Å)
Cite:The crystal structure of murine p97/VCP at 3.6A
J.Struct.Biol., 144, 2003

224004

数据于2024-08-21公开中

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