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4LKD
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BU of 4lkd by Molmil
Crystal Structure of Pseudomonas aeruginosa Lectin LecA Complexed with GalA-QRS at 2.31 A Resolution
Descriptor: CALCIUM ION, P-HYDROXYBENZOIC ACID, PA-I galactophilic lectin, ...
Authors:Kadam, R.U, Stocker, A, Reymond, J.-L.
Deposit date:2013-07-07
Release date:2013-12-18
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.307 Å)
Cite:Structure-Based Optimization of the Terminal Tripeptide in Glycopeptide Dendrimer Inhibitors of Pseudomonas aeruginosa Biofilms Targeting LecA.
Chemistry, 19, 2013
1GJ2
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BU of 1gj2 by Molmil
CO(III)-BLEOMYCIN-OOH BOUND TO AN OLIGONUCLEOTIDE CONTAINING A PHOSPHOGLYCOLATE LESION
Descriptor: 2-PHOSPHOGLYCOLIC ACID, 5'-D(*CP*CP*AP*AP*AP*G)-3', 5'-D(*CP*CP*CP*AP*GP*TP*AP*CP*TP*TP*TP*GP*G)-3', ...
Authors:Hoehn, S.T, Junker, H.-D, Bunt, R.C, Turner, C.J, Stubbe, J.
Deposit date:2000-11-01
Release date:2001-06-06
Last modified:2024-07-10
Method:SOLUTION NMR
Cite:Solution structure of Co(III)-bleomycin-OOH bound to a phosphoglycolate lesion containing oligonucleotide: implications for bleomycin-induced double-strand DNA cleavage.
Biochemistry, 40, 2001
4IW1
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BU of 4iw1 by Molmil
HSA-fructose complex
Descriptor: D-fructose, PHOSPHATE ION, Serum albumin, ...
Authors:Wang, Y, Yu, H, Shi, X, Huang, M.
Deposit date:2013-01-23
Release date:2013-04-24
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.56 Å)
Cite:Structural mechanism of ring-opening reaction of glucose by human serum albumin
J.Biol.Chem., 288, 2013
1QCP
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BU of 1qcp by Molmil
CRYSTAL STRUCTURE OF THE RWJ-51084 BOVINE PANCREATIC BETA-TRYPSIN AT 1.8 A
Descriptor: CALCIUM ION, CYCLOPENTANECARBOXYLIC ACID [1-(BENZOTHIAZOLE-2-CARBONYL)-4-GUANIDINO-BUTYL]-AMIDE, PROTEIN (BETA-TRYPSIN PROTEIN)
Authors:Recacha, R, Carson, M, Costanzo, M.J, Maryanoff, B, Chattopadhyay, D.
Deposit date:1999-05-10
Release date:1999-05-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structure of the RWJ-51084-bovine pancreatic beta-trypsin complex at 1.8 A.
Acta Crystallogr.,Sect.D, 55, 1999
3F0E
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BU of 3f0e by Molmil
Crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase from Burkholderia pseudomallei
Descriptor: 2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase, MAGNESIUM ION, ZINC ION
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2008-10-24
Release date:2008-11-04
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Leveraging structure determination with fragment screening for infectious disease drug targets: MECP synthase from Burkholderia pseudomallei.
J Struct Funct Genomics, 12, 2011
1KN4
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BU of 1kn4 by Molmil
CATALYTIC ANTIBODY D2.3 COMPLEX
Descriptor: IG ANTIBODY D2.3 (HEAVY CHAIN), IG ANTIBODY D2.3 (LIGHT CHAIN), PARA-NITROPHENYL PHOSPHONOBUTANOYL D-ALANINE, ...
Authors:Gigant, B, Knossow, M.
Deposit date:2001-12-18
Release date:2002-03-13
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Remarkable remote chiral recognition in a reaction mediated by a catalytic antibody.
J.Am.Chem.Soc., 124, 2002
4DVX
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BU of 4dvx by Molmil
Crystal structure of clade A/E 93TH057 HIV-1 gp120 core in complex with MAE-II-188
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, N-(4-chloro-3-fluorophenyl)-N'-{[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl}ethanediamide, ...
Authors:Kwon, Y.D, Kwong, P.D.
Deposit date:2012-02-23
Release date:2013-02-27
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal Structures of HIV-1 gp120 Envelope Glycoprotein in Complex with NBD Analogues That Target the CD4-Binding Site.
Plos One, 9, 2014
1QNP
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BU of 1qnp by Molmil
The 3-D structure of a Trichoderma reesei b-mannanase from glycoside hydrolase family 5
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, ENDO-1,4-B-D-MANNANASE, GLYCEROL, ...
Authors:Sabini, E, Schubert, H, Murshudov, G, Wilson, K.S, Siika-Aho, M, Penttila, M.
Deposit date:1999-10-20
Release date:2000-10-19
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The Three-Dimensional Structure of a Trichoderma Reesei Beta-Mannanase from Glycoside Hydrolase Family 5.
Acta Crystallogr.,Sect.D, 56, 2000
1YO8
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BU of 1yo8 by Molmil
Structure of the C-terminal domain of human thrombospondin-2
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
Authors:Carlson, C.B, Bernstein, D.A, Annis, D.S, Misenheimer, T.M, Hannah, B.A, Mosher, D.F, Keck, J.L.
Deposit date:2005-01-26
Release date:2005-09-27
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure of the calcium-rich signature domain of human thrombospondin-2
Nat.Struct.Mol.Biol., 12, 2005
3SXP
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BU of 3sxp by Molmil
Crystal Structure of Helicobacter pylori ADP-L-glycero-D-manno-heptose-6-epimerase (rfaD, HP0859)
Descriptor: ADP-L-glycero-D-mannoheptose-6-epimerase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Shaik, M.M, Zanotti, G, Cendron, L.
Deposit date:2011-07-15
Release date:2012-02-08
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:The crystal structure of ADP-L-glycero-D-manno-heptose-6-epimerase (HP0859) from Helicobacter pylori.
Biochim.Biophys.Acta, 1814, 2011
3WT7
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BU of 3wt7 by Molmil
Crystal structure of VDR-LBD complexed with 22R-Butyl-2-methylidene-26,27-dimethyl-19,24-dinor-1 ,25-dihydroxyvitamin D3
Descriptor: (1R,3R,7E,17beta)-17-[(2R,3R)-3-butyl-5-ethyl-5-hydroxyheptan-2-yl]-2-methylidene-9,10-secoestra-5,7-diene-1,3-diol, Mediator of RNA polymerase II transcription subunit 1, Vitamin D3 receptor
Authors:Anami, Y, Itoh, T, Yamamoto, K.
Deposit date:2014-04-08
Release date:2014-06-11
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:A Mixed Population of Antagonist and Agonist Binding Conformers in a Single Crystal Explains Partial Agonism against Vitamin D Receptor: Active Vitamin D Analogues with 22R-Alkyl Group.
J.Med.Chem., 57, 2014
1LFG
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BU of 1lfg by Molmil
Structure of diferric human lactoferrin
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, CARBONATE ION, FE (III) ION, ...
Authors:Baker, E.N, Anderson, B.F, Haridas, M.
Deposit date:1992-02-05
Release date:1994-01-31
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structure of human diferric lactoferrin refined at 2.2 A resolution.
Acta Crystallogr.,Sect.D, 51, 1995
3TDX
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BU of 3tdx by Molmil
Crystal structure of HSC L82V
Descriptor: CHLORIDE ION, TETRAETHYLENE GLYCOL, formate/nitrite transporter, ...
Authors:Czyzewski, B.K, Wang, D.-N.
Deposit date:2011-08-11
Release date:2012-03-07
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Identification and characterization of a bacterial hydrosulphide ion channel.
Nature, 483, 2012
1Q90
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BU of 1q90 by Molmil
Structure of the cytochrome b6f (plastohydroquinone : plastocyanin oxidoreductase) from Chlamydomonas reinhardtii
Descriptor: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, 8-HYDROXY-5,7-DIMETHOXY-3-METHYL-2-TRIDECYL-4H-CHROMEN-4-ONE, ...
Authors:Stroebel, D, Choquet, Y, Popot, J.-L, Picot, D.
Deposit date:2003-08-22
Release date:2003-12-09
Last modified:2021-03-03
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:An Atypical Haem in the Cytochrome B6F Complex
Nature, 426, 2003
5BYY
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BU of 5byy by Molmil
ERK5 IN COMPLEX WITH SMALL MOLECULE
Descriptor: 2-{[2-ethoxy-4-(4-hydroxypiperidin-1-yl)phenyl]amino}-5,11-dimethyl-5,11-dihydro-6H-pyrimido[4,5-b][1,4]benzodiazepin-6-one, Mitogen-activated protein kinase 7
Authors:Chen, H, Tucker, J, Wang, X, Gavine, P.R, Philips, C, Augustin, M.A, Schreiner, P, Steinbacher, S, Preston, M, Ogg, D.
Deposit date:2015-06-11
Release date:2016-05-04
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.79 Å)
Cite:Discovery of a novel allosteric inhibitor-binding site in ERK5: comparison with the canonical kinase hinge ATP-binding site.
Acta Crystallogr D Struct Biol, 72, 2016
3TDS
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BU of 3tds by Molmil
Crystal structure of HSC F194I
Descriptor: TETRAETHYLENE GLYCOL, formate/nitrite transporter, octyl beta-D-glucopyranoside
Authors:Czyzewski, B.K, Wang, D.-N.
Deposit date:2011-08-11
Release date:2012-03-07
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.975 Å)
Cite:Identification and characterization of a bacterial hydrosulphide ion channel.
Nature, 483, 2012
4CYF
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BU of 4cyf by Molmil
The structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, PANTETHEINASE
Authors:Boersma, Y.L, Newman, J, Adams, T.E, Sparrow, L, Cowieson, N, Lucent, D, Krippner, G, Bozaoglu, K, Peat, T.S.
Deposit date:2014-04-11
Release date:2014-12-10
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:The Structure of Vanin-1: A Key Enzyme Linking Metabolic Disease and Inflammation
Acta Crystallogr.,Sect.D, 70, 2014
4J5T
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BU of 4j5t by Molmil
Crystal structure of Processing alpha-Glucosidase I
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Mannosyl-oligosaccharide glucosidase
Authors:Barker, M.K, Rose, D.R.
Deposit date:2013-02-09
Release date:2013-04-03
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Specificity of processing alpha-glucosidase I is guided by the substrate conformation: crystallographic and in silico studies.
J.Biol.Chem., 288, 2013
4LSU
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BU of 4lsu by Molmil
Crystal structure of broadly and potently neutralizing antibody VRC-PG20 in complex with HIV-1 clade A/E 93TH057 gp120
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ...
Authors:Zhou, T, Moquin, S, Kwong, P.D.
Deposit date:2013-07-23
Release date:2013-08-21
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Multidonor Analysis Reveals Structural Elements, Genetic Determinants, and Maturation Pathway for HIV-1 Neutralization by VRC01-Class Antibodies.
Immunity, 39, 2013
2YIK
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BU of 2yik by Molmil
Catalytic domain of Clostridium thermocellum CelT
Descriptor: CALCIUM ION, ENDOGLUCANASE, ZINC ION
Authors:Tsai, J.-Y, Kesavulu, M.M, Hsiao, C.-D.
Deposit date:2011-05-16
Release date:2012-02-29
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structure of the Catalytic Domain of the Clostridium Thermocellum Cellulase Celt
Acta Crystallogr.,Sect.D, 68, 2012
4D3Y
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BU of 4d3y by Molmil
The structure of inactive prolegumain from chinese hamster.
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, LEGUMAIN
Authors:Li, W, Heinz, D.W, Krausze, J.
Deposit date:2014-10-24
Release date:2016-01-20
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:A Detailed Look Into Chinese Hamster Legumain Active Site Structure and Exploration of its Function
To be Published
3BIU
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BU of 3biu by Molmil
Human thrombin-in complex with UB-THR10
Descriptor: (S)-N-(4-carbamimidoylbenzyl)-1-(2-(cyclopentylamino)ethanoyl)pyrrolidine-2-carboxamide, 2-acetamido-2-deoxy-beta-D-glucopyranose, Hirudin, ...
Authors:Gerlach, C, Smolinski, M, Steuber, H, Sotriffer, C.A, Heine, A, Hangauer, D.G, Klebe, G.
Deposit date:2007-12-01
Release date:2007-12-25
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Thermodynamic Inhibition Profile of a Cyclopentyl and a Cyclohexyl Derivative towards Thrombin: The Same but for Different Reasons
Angew.Chem.Int.Ed.Engl., 46, 2007
1CCZ
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BU of 1ccz by Molmil
CRYSTAL STRUCTURE OF THE CD2-BINDING DOMAIN OF CD58 (LYMPHOCYTE FUNCTION-ASSOCIATED ANTIGEN 3) AT 1.8-A RESOLUTION
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, PROTEIN (CD58)
Authors:Ikemizu, S, Sparks, L.M, Van Der Merwe, P.A, Harlos, K, Stuart, D.I, Jones, E.Y, Davis, S.J.
Deposit date:1999-03-02
Release date:1999-04-05
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of the CD2-binding domain of CD58 (lymphocyte function-associated antigen 3) at 1.8-A resolution.
Proc.Natl.Acad.Sci.USA, 96, 1999
3B4A
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BU of 3b4a by Molmil
T. tengcongensis glmS ribozyme with G40A mutation, bound to glucosamine-6-phosphate
Descriptor: 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose, MAGNESIUM ION, glmS ribozyme RNA, ...
Authors:Klein, D.J, Ferre-D'Amare, A.R.
Deposit date:2007-10-23
Release date:2007-12-11
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Essential Role of an Active-Site Guanine in glmS Ribozyme Catalysis.
J.Am.Chem.Soc., 129, 2007
1QNS
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BU of 1qns by Molmil
The 3-D structure of a Trichoderma reesei b-mannanase from glycoside hydrolase family 5
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ENDO-1,4-B-D-MANNANASE, ...
Authors:Sabini, E, Schubert, H, Murshudov, G, Wilson, K.S, Siika-Aho, M, Penttila, M.
Deposit date:1999-10-20
Release date:2000-10-19
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The Three-Dimensional Structure of a Trichoderma Reesei Beta-Mannanase from Glycoside Hydrolase Family 5
Acta Crystallogr.,Sect.D, 56, 2000

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