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4CCY
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BU of 4ccy by Molmil
Crystal structure of carboxylesterase CesB (YbfK) from Bacillus subtilis
Descriptor: CARBOXYLESTERASE YBFK, SODIUM ION
Authors:Rozeboom, H.J, Godinho, L.F, Nardini, M, Quax, W.J, Dijkstra, B.W.
Deposit date:2013-10-29
Release date:2014-01-22
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Crystal Structures of Two Bacillus Carboxylesterases with Different Enantioselectivities.
Biochim.Biophys.Acta, 1844, 2014
3EPT
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BU of 3ept by Molmil
Structure of the rebeccamycin biosynthetic enzyme RebC with reduced flavin
Descriptor: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, RebC, SODIUM ION
Authors:Ryan, K.S, Drennan, C.L.
Deposit date:2008-09-30
Release date:2008-12-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.97 Å)
Cite:The FAD cofactor of RebC shifts to an IN conformation upon flavin reduction
Biochemistry, 47, 2008
1INY
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BU of 1iny by Molmil
A SIALIC ACID DERIVED PHOSPHONATE ANALOG INHIBITS DIFFERENT STRAINS OF INFLUENZA VIRUS NEURAMINIDASE WITH DIFFERENT EFFICIENCIES
Descriptor: (1R)-4-acetamido-1,5-anhydro-2,4-dideoxy-1-phosphono-D-glycero-D-galacto-octitol, 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
Authors:White, C.L, Janakiraman, M.N, Laver, W.G, Philippon, C, Vasella, A, Air, G.M, Luo, M.
Deposit date:1994-09-26
Release date:1995-02-07
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:A sialic acid-derived phosphonate analog inhibits different strains of influenza virus neuraminidase with different efficiencies.
J.Mol.Biol., 245, 1995
2ONJ
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BU of 2onj by Molmil
Structure of the multidrug ABC transporter Sav1866 from S. aureus in complex with AMP-PNP
Descriptor: Multidrug export ATP-binding/permease protein SAV1866, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, SODIUM ION
Authors:Dawson, R.J.P, Locher, K.P.
Deposit date:2007-01-24
Release date:2007-03-13
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Structure of the multidrug ABC transporter Sav1866 from Staphylococcus aureus in complex with AMP-PNP.
Febs Lett., 581, 2007
4JMY
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BU of 4jmy by Molmil
Crystal structure of HCV NS3/NS4A protease complexed with DDIVPC peptide
Descriptor: HCV non-structural protein 4A, Polyprotein, SODIUM ION, ...
Authors:Lemke, C.T.
Deposit date:2013-03-14
Release date:2013-10-30
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Importance of the peptide scaffold of drugs that target the hepatitis C virus NS3 protease and its crucial bioactive conformation and dynamic factors.
To be Published
3G6N
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BU of 3g6n by Molmil
Crystal structure of an EfPDF complex with Met-Ala-Ser
Descriptor: FE (III) ION, Peptide deformylase, SODIUM ION, ...
Authors:Hwang, K.Y, Nam, K.H.
Deposit date:2009-02-07
Release date:2009-03-03
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of an EfPDF complex with Met-Ala-Ser based on crystallographic packing.
Biochem.Biophys.Res.Commun., 381, 2009
1JEE
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BU of 1jee by Molmil
Crystal Structure of ATP Sulfurylase in complex with chlorate
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETIC ACID, ADENOSINE-5'-PHOSPHOSULFATE, ...
Authors:Ullrich, T.C, Huber, R.
Deposit date:2001-06-17
Release date:2001-11-14
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:The complex structures of ATP sulfurylase with thiosulfate, ADP and chlorate reveal new insights in inhibitory effects and the catalytic cycle.
J.Mol.Biol., 313, 2001
2RTB
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BU of 2rtb by Molmil
APOSTREPTAVIDIN, PH 3.32, SPACE GROUP I222
Descriptor: ACETATE ION, CHLORIDE ION, SODIUM ION, ...
Authors:Katz, B.A.
Deposit date:1997-09-11
Release date:1998-10-14
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Binding of biotin to streptavidin stabilizes intersubunit salt bridges between Asp61 and His87 at low pH.
J.Mol.Biol., 274, 1997
2Q68
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BU of 2q68 by Molmil
Crystal Structure of Nak channel D66A, S70E double mutants
Descriptor: CALCIUM ION, Potassium channel protein, SODIUM ION
Authors:Alam, A, Shi, N, Jiang, Y.
Deposit date:2007-06-04
Release date:2007-10-02
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural insight into Ca2+ specificity in tetrameric cation channels.
Proc.Natl.Acad.Sci.Usa, 104, 2007
2R5O
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BU of 2r5o by Molmil
Crystal structure of the C-terminal domain of wzt
Descriptor: CHLORIDE ION, Putative ATP binding component of ABC-transporter, SODIUM ION, ...
Authors:Kimber, M.S, Cuthbertson, L, Whitfield, C.
Deposit date:2007-09-04
Release date:2007-12-25
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Substrate binding by a bacterial ABC transporter involved in polysaccharide export.
Proc.Natl.Acad.Sci.Usa, 104, 2007
3PAK
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BU of 3pak by Molmil
Crystal Structure of Rat Surfactant Protein A neck and carbohydrate recognition domain (NCRD) complexed with Mannose
Descriptor: CALCIUM ION, Pulmonary surfactant-associated protein A, SODIUM ION, ...
Authors:Shang, F, Rynkiewicz, M.J, McCormack, F.X, Wu, H, Cafarella, T.M, Head, J, Seaton, B.A.
Deposit date:2010-10-19
Release date:2010-11-03
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystallographic complexes of surfactant protein A and carbohydrates reveal ligand-induced conformational change.
J.Biol.Chem., 286, 2011
3GBV
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BU of 3gbv by Molmil
Crystal structure of a putative LacI transcriptional regulator from Bacteroides fragilis
Descriptor: 1,2-ETHANEDIOL, Putative LacI-family transcriptional regulator, SODIUM ION
Authors:Syed Ibrahim, B, Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2009-02-20
Release date:2009-03-10
Last modified:2021-02-10
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure of a putative LacI transcriptional regulator from Bacteroides fragilis
To be Published
4JVM
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BU of 4jvm by Molmil
Crystal structure of human estrogen sulfotransferase (SULT1E1) in complex with inactive cofactor PAP and brominated flame retardant TBBPA (tetrabromobisphenol A)
Descriptor: 1,2-ETHANEDIOL, 4,4'-propane-2,2-diylbis(2,6-dibromophenol), ADENOSINE-3'-5'-DIPHOSPHATE, ...
Authors:Gosavi, R.A, Knudsen, G.A, Birnbaum, L.S, Pedersen, L.C.
Deposit date:2013-03-25
Release date:2013-09-04
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.994 Å)
Cite:Mimicking of Estradiol Binding by Flame Retardants and Their Metabolites: A Crystallographic Analysis.
Environ.Health Perspect., 121, 2013
2XO2
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BU of 2xo2 by Molmil
Human Annexin V with incorporated Methionine analogue Azidohomoalanine
Descriptor: ANNEXIN A5, CALCIUM ION, CHLORIDE ION, ...
Authors:Debela, M, Merkel, L, Goettig, P, Budisa, N.
Deposit date:2010-08-09
Release date:2011-08-03
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Non-Canonical Amino Acids for Click Chemistry Reactions Incorporated in Human Annexin V
To be Published
3DJ0
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BU of 3dj0 by Molmil
Crystallization of the Thermotoga maritima lysine riboswitch bound to L-4-oxalysine
Descriptor: O-(2-aminoethyl)-L-serine, POTASSIUM ION, RNA (174-MER), ...
Authors:Serganov, A.A.
Deposit date:2008-06-21
Release date:2008-09-16
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural insights into amino acid binding and gene control by a lysine riboswitch.
Nature, 455, 2008
4CSH
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BU of 4csh by Molmil
Native structure of the lytic CHAPK domain of the endolysin LysK from Staphylococcus aureus bacteriophage K
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GLYCEROL, ...
Authors:Sanz-Gaitero, M, Keary, R, Garcia-Doval, C, Coffey, A, van Raaij, M.J.
Deposit date:2014-03-07
Release date:2014-08-06
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Crystal structure of the lytic CHAP(K) domain of the endolysin LysK from Staphylococcus aureus bacteriophage K.
Virol. J., 11, 2014
4H8R
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BU of 4h8r by Molmil
Imipenem complex of GES-5 carbapenemase
Descriptor: (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carbox ylic acid, Extended-spectrum beta-lactamase GES-5, IODIDE ION, ...
Authors:Smith, C.A, Vakulenko, S.B.
Deposit date:2012-09-23
Release date:2013-07-24
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Structural basis for progression toward the carbapenemase activity in the GES family of beta-lactamases.
J.Am.Chem.Soc., 134, 2012
4JVL
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BU of 4jvl by Molmil
Crystal structure of human estrogen sulfotransferase (SULT1E1) in complex with inactive cofactor PAP and estradiol (E2)
Descriptor: 1,2-ETHANEDIOL, ADENOSINE-3'-5'-DIPHOSPHATE, ESTRADIOL, ...
Authors:Gosavi, R.A, Knudsen, G.A, Birnbaum, L.S, Pedersen, L.C.
Deposit date:2013-03-25
Release date:2013-09-04
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.943 Å)
Cite:Mimicking of Estradiol Binding by Flame Retardants and Their Metabolites: A Crystallographic Analysis.
Environ.Health Perspect., 121, 2013
4J6W
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BU of 4j6w by Molmil
Crystal structure of HFQ from Pseudomonas aeruginosa in complex with CTP
Descriptor: CHLORIDE ION, CYTIDINE-5'-DIPHOSPHATE, CYTIDINE-5'-MONOPHOSPHATE, ...
Authors:Nikulin, A.D, Murina, V, Lekontseva, N.
Deposit date:2013-02-12
Release date:2013-07-31
Last modified:2024-07-03
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Hfq binds ribonucleotides in three different RNA-binding sites.
Acta Crystallogr.,Sect.D, 69, 2013
3H2Z
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BU of 3h2z by Molmil
The crystal structure of mannitol-1-phosphate dehydrogenase from Shigella flexneri
Descriptor: ACETATE ION, GLYCEROL, Mannitol-1-phosphate 5-dehydrogenase, ...
Authors:Wu, R, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-04-15
Release date:2009-06-16
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The crystal structure of mannitol-1-phosphate dehydrogenase from Shigella flexneri
To be Published
4C3V
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BU of 4c3v by Molmil
Extensive counter-ion interactions with subtilisin in aqueous medium, no Cs soak
Descriptor: CALCIUM ION, SODIUM ION, SUBTILISIN CARLSBERG, ...
Authors:Cianci, M, Negroni, J, Helliwell, J.R, Halling, P.J.
Deposit date:2013-08-27
Release date:2014-08-20
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Extensive Counter-Ion Interactions Seen at the Surface of Subtilisin in an Aqueous Medium
Rsc Adv, 2014
2O11
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BU of 2o11 by Molmil
Mycobacterium tuberculosis Chorismate synthase
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETATE ION, Chorismate synthase, ...
Authors:Bruning, M, Bartunik, H.D.
Deposit date:2006-11-28
Release date:2008-04-08
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Complexes of Chorismate synthase from M. tuberculosis
To be Published
4JHG
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BU of 4jhg by Molmil
Crystal Structure of Medicago truncatula Nodulin 13 (MtN13) in complex with trans-zeatin
Descriptor: (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol, MALONATE ION, MtN13 protein, ...
Authors:Ruszkowski, M, Tusnio, K, Ciesielska, A, Brzezinski, K, Dauter, M, Dauter, Z, Sikorski, M, Jaskolski, M.
Deposit date:2013-03-05
Release date:2013-03-20
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:The landscape of cytokinin binding by a plant nodulin.
Acta Crystallogr.,Sect.D, 69, 2013
3CKI
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BU of 3cki by Molmil
Crystal structure of the TACE-N-TIMP-3 complex
Descriptor: ADAM 17, Metalloproteinase inhibitor 3, SODIUM ION, ...
Authors:Wisniewska, M, Goettig, P, Maskos, K, Belouski, E, Winters, D, Hecht, R, Black, R, Bode, W.
Deposit date:2008-03-15
Release date:2008-08-05
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural determinants of the ADAM inhibition by TIMP-3: crystal structure of the TACE-N-TIMP-3 complex.
J.Mol.Biol., 381, 2008
1XSL
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BU of 1xsl by Molmil
Crystal Structure of human DNA polymerase lambda in complex with a one nucleotide DNA gap
Descriptor: 5'-D(*CP*GP*GP*CP*AP*GP*CP*GP*CP*AP*C)-3', 5'-D(*GP*TP*GP*CP*GP*C)-3', 5'-D(P*GP*CP*CP*G)-3', ...
Authors:Garcia-Diaz, M, Bebenek, K, Krahn, J.M, Kunkel, T.A, Pedersen, L.C.
Deposit date:2004-10-19
Release date:2005-01-18
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:A closed conformation for the Pol lambda catalytic cycle.
Nat.Struct.Mol.Biol., 12, 2005

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