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1GUG
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MOPII FROM CLOSTRIDIUM PASTEURIANUM COMPLEXED WITH TUNGSTATE
Descriptor:MOLYBDATE BINDING PROTEIN II, TUNGSTATE(VI)ION, CHLORIDE ION, ...
Authors:Schuettelkopf, A.W., Harrison, J.A., Hunter, W.N.
Deposit date:2002-01-25
Release date:2002-02-08
Last modified:2012-04-18
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Passive Acquisition of Ligand by the Mopii Molbindin from Clostridium Pasteurianum: Structures of Apo and Oxyanion-Bound Forms
J.Biol.Chem., 277, 2002
1GUN
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MOPII FROM CLOSTRIDIUM PASTEURIANUM COMPLEXED WITH MOLYBDATE (PARTIAL)
Descriptor:MOLYBDATE BINDING PROTEIN II, MOLYBDATE ION, CALCIUM ION
Authors:Schuettelkopf, A.W., Harrison, J.A., Hunter, W.N.
Deposit date:2002-01-28
Release date:2002-02-08
Last modified:2012-05-02
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Passive Acquisition of Ligand by the Mopii Molbindin from Clostridium Pasteurianum: Structures of Apo and Oxyanion-Bound Forms
J.Biol.Chem., 277, 2002
1GUO
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MOPII FROM CLOSTRIDIUM PASTEURIANUM COMPLEXED WITH MOLYBDATE
Descriptor:MOLYBDATE BINDING PROTEIN II, MOLYBDATE ION
Authors:Schuettelkopf, A.W., Harrison, J.A., Hunter, W.N.
Deposit date:2002-01-28
Release date:2002-02-08
Last modified:2012-05-16
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Passive Acquisition of Ligand by the Mopii Molbindin from Clostridium Pasteurianum: Structures of Apo and Oxyanion-Bound Forms
J.Biol.Chem., 277, 2002
1GUS
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MOPII FROM CLOSTRIDIUM PASTEURIANUM (APO1)
Descriptor:MOLYBDATE BINDING PROTEIN II, MAGNESIUM ION, CHLORIDE ION
Authors:Schuettelkopf, A.W., Harrison, J.A., Hunter, W.N.
Deposit date:2002-01-28
Release date:2002-02-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Passive Acquisition of Ligand by the Mopii Molbindin from Clostridium Pasteurianum: Structures of Apo and Oxyanion-Bound Forms
J.Biol.Chem., 277, 2002
1GUT
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MOPII FROM CLOSTRIDIUM PASTEURIANUM (APO2)
Descriptor:MOLYBDATE BINDING PROTEIN II, CHLORIDE ION, MAGNESIUM ION
Authors:Schuettelkopf, A.W., Harrison, J.A., Hunter, W.N.
Deposit date:2002-01-28
Release date:2002-02-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Passive Acquisition of Ligand by the Mopii Molbindin from Clostridium Pasteurianum: Structures of Apo and Oxyanion-Bound Forms
J.Biol.Chem., 277, 2002
2BF7
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LEISHMANIA MAJOR PTERIDINE REDUCTASE 1 IN COMPLEX WITH NADP AND BIOPTERIN
Descriptor:PTERIDINE REDUCTASE 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 7,8-DIHYDROBIOPTERIN, ...
Authors:Schuettelkopf, A.W., Hunter, W.N.
Deposit date:2004-12-06
Release date:2005-08-31
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structures of Leishmania Major Pteridine Reductase Complexes Reveal the Active Site Features Important for Ligand Binding and to Guide Inhibitor Design
J.Mol.Biol., 352, 2005
2BFA
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LEISHMANIA MAJOR PTERIDINE REDUCTASE 1 IN COMPLEX WITH NADP AND CB3717
Descriptor:PTERIDINE REDUCTASE 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 10-PROPARGYL-5,8-DIDEAZAFOLIC ACID, ...
Authors:Schuettelkopf, A.W., Hunter, W.N.
Deposit date:2004-12-06
Release date:2005-08-31
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structures of Leishmania Major Pteridine Reductase Complexes Reveal the Active Site Features Important for Ligand Binding and to Guide Inhibitor Design
J.Mol.Biol., 352, 2005
2BFM
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LEISHMANIA MAJOR PTERIDINE REDUCTASE 1 IN COMPLEX WITH NADP AND TRIMETHOPRIM
Descriptor:PTERIDINE REDUCTASE 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, TRIMETHOPRIM
Authors:Schuettelkopf, A.W., Hunter, W.N.
Deposit date:2004-12-09
Release date:2005-08-31
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structures of Leishmania Major Pteridine Reductase Complexes Reveal the Active Site Features Important for Ligand Binding and to Guide Inhibitor Design
J.Mol.Biol., 352, 2005
2BFO
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LEISHMANIA MAJOR PTERIDINE REDUCTASE 1 IN COMPLEX WITH NADPH
Descriptor:PTERIDINE REDUCTASE 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 1,2-ETHANEDIOL
Authors:Schuettelkopf, A.W., Hunter, W.N.
Deposit date:2004-12-10
Release date:2005-08-31
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structures of Leishmania Major Pteridine Reductase Complexes Reveal the Active Site Features Important for Ligand Binding and to Guide Inhibitor Design
J.Mol.Biol., 352, 2005
2BFP
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LEISHMANIA MAJOR PTERIDINE REDUCTASE 1 IN COMPLEX WITH NADP AND TETRAHYDROBIOPTERIN
Descriptor:PTERIDINE REDUCTASE 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 5,6,7,8-TETRAHYDROBIOPTERIN, ...
Authors:Schuettelkopf, A.W., Hunter, W.N.
Deposit date:2004-12-10
Release date:2005-08-31
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Structures of Leishmania Major Pteridine Reductase Complexes Reveal the Active Site Features Important for Ligand Binding and to Guide Inhibitor Design
J.Mol.Biol., 352, 2005
1E92
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PTERIDINE REDUCTASE 1 FROM LEISHMANIA MAJOR COMPLEXED WITH NADP+ AND DIHYDROBIOPTERIN
Descriptor:PTERIDINE REDUCTASE 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 7,8-DIHYDROBIOPTERIN, ...
Authors:Schuettelkopf, A.W., Hunter, W.N.
Deposit date:2000-10-04
Release date:2001-10-05
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Pteridine Reductase Mechanism Correlates Pterin Metabolism with Drug Resistance in Trypanosomatid Parasites
Nat.Struct.Biol., 8, 2001
2XVP
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CHIA1 FROM ASPERGILLUS FUMIGATUS, APOSTRUCTURE
Descriptor:CLASS III CHITINASE CHIA1, PHOSPHATE ION
Authors:Schuettelkopf, A.W., van Aalten, D.M.F.
Deposit date:2010-10-27
Release date:2011-06-01
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Natural Product-Guided Discovery of a Fungal Chitinase Inhibitor.
Chem.Biol., 17, 2010
4AP0
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THE MITOTIC KINESIN EG5 IN COMPLEX WITH MG-ADP AND ISPINESIB
Descriptor:KINESIN-LIKE PROTEIN KIF11, MAGNESIUM ION, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Schuettelkopf, A.W., Talapatra, S.K., Kozielski, F.
Deposit date:2012-03-30
Release date:2012-09-26
Last modified:2012-10-03
Method:X-RAY DIFFRACTION (2.594 Å)
Cite:The Structure of the Ternary Eg5-Adp-Ispinesib Complex
Acta Crystallogr.,Sect.D, 68, 2012
4TXE
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SCCTS1 IN COMPLEX WITH COMPOUND 5
Descriptor:Endochitinase, (2S)-1-(2,3-dihydro-1H-inden-2-ylamino)-3-(3,4-dimethylphenoxy)propan-2-ol
Authors:Schuettelkopf, A.W., van Aalten, D.M.F.
Deposit date:2014-07-03
Release date:2014-08-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Screening-based discovery of Aspergillus fumigatus plant-type chitinase inhibitors
FEBS Lett, 588, 2014
3ZF8
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CRYSTAL STRUCTURE OF SACCHAROMYCES CEREVISIAE MNN9 IN COMPLEX WITH GDP AND MN.
Descriptor:MANNAN POLYMERASE COMPLEXES SUBUNIT MNN9, GUANOSINE-5'-DIPHOSPHATE, MANGANESE (II) ION
Authors:Striebeck, A., Schuettelkopf, A.W., van Aalten, D.M.F.
Deposit date:2012-12-10
Release date:2013-09-25
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Yeast Mnn9 is Both a Priming Glycosyltransferase and an Allosteric Activator of Mannan Biosynthesis.
Open Biol., 3, 2013
4AY5
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HUMAN O-GLCNAC TRANSFERASE (OGT) IN COMPLEX WITH UDP AND GLYCOPEPTIDE
Descriptor:UDP-N-ACETYLGLUCOSAMINE--PEPTIDE N-ACETYLGLUCOSAMINYL TRANSFERASE 110 KDA SUBUNIT, GTAB1TIDE, URIDINE-5'-DIPHOSPHATE, ...
Authors:Schimpl, M., Zheng, X., Blair, D.E., Schuettelkopf, A.W., Navratilova, I., Aristotelous, T., Ferenbach, A.T., Macnaughtan, M.A., Borodkin, V.S., van Aalten, D.M.F.
Deposit date:2012-06-18
Release date:2012-10-24
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (3.15 Å)
Cite:O-Glcnac Transferase Invokes Nucleotide Sugar Pyrophosphate Participation in Catalysis
Nat.Chem.Biol., 8, 2012
4AY6
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HUMAN O-GLCNAC TRANSFERASE (OGT) IN COMPLEX WITH UDP-5SGLCNAC AND SUBSTRATE PEPTIDE
Descriptor:UDP-N-ACETYLGLUCOSAMINE--PEPTIDE N-ACETYLGLUCOSAMINYLTRANS FERASE 110 KDA SUBUNIT, TGF-BETA-ACTIVATED KINASE 1 AND MAP3K7-BINDING PROTEIN 1, SULFATE ION, ...
Authors:Schimpl, M., Zheng, X., Blair, D.E., Schuettelkopf, A.W., Navratilova, I., Aristotelous, T., Ferenbach, A.T., Macnaughtan, M.A., Borodkin, V.S., van Aalten, D.M.F.
Deposit date:2012-06-18
Release date:2012-10-24
Last modified:2012-12-12
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:O-Glcnac Transferase Invokes Nucleotide Sugar Pyrophosphate Participation in Catalysis
Nat.Chem.Biol., 8, 2012
2CH9
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CRYSTAL STRUCTURE OF DIMERIC HUMAN CYSTATIN F
Descriptor:CYSTATIN F, N-ACETYL-D-GLUCOSAMINE, BETA-L-FUCOSE, ...
Authors:Schuettelkopf, A.W., van Aalten, D.M.F.
Deposit date:2006-03-13
Release date:2006-04-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural Basis of Reduction-Dependent Activation of Human Cystatin F.
J.Biol.Chem., 281, 2006
2JLB
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XANTHOMONAS CAMPESTRIS PUTATIVE OGT (XCC0866), COMPLEX WITH UDP- GLCNAC PHOSPHONATE ANALOGUE
Descriptor:XCC0866, URIDINE-DIPHOSPHATE-METHYLENE-N-ACETYL-GLUCOSAMINE, MANGANESE (II) ION, ...
Authors:Schuettelkopf, A.W., Clarke, A.J., van Aalten, D.M.F.
Deposit date:2008-09-07
Release date:2008-11-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural Insights Into Mechanism and Specificity of O-Glcnac Transferase.
Embo J., 27, 2008
2VSY
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XANTHOMONAS CAMPESTRIS PUTATIVE OGT (XCC0866), APOSTRUCTURE
Descriptor:XCC0866, 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, DI(HYDROXYETHYL)ETHER, ...
Authors:Schuettelkopf, A.W., Clarke, A.J., van Aalten, D.M.F.
Deposit date:2008-05-01
Release date:2008-11-18
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural Insights Into Mechanism and Specificity of O-Glcnac Transferase.
Embo J., 27, 2008
2W61
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SACCHAROMYCES CEREVISIAE GAS2P APOSTRUCTURE (E176Q MUTANT)
Descriptor:GLYCOLIPID-ANCHORED SURFACE PROTEIN 2
Authors:Schuettelkopf, A.W., Hurtado-Guerrero, R., van Aalten, D.M.F.
Deposit date:2008-12-16
Release date:2009-02-10
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Molecular Mechanisms of Yeast Cell Wall Glucan Remodeling.
J.Biol.Chem., 284, 2009
2W62
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SACCHAROMYCES CEREVISIAE GAS2P IN COMPLEX WITH LAMINARIPENTAOSE
Descriptor:GLYCOLIPID-ANCHORED SURFACE PROTEIN 2, BETA-D-GLUCOSE, 1,4-BUTANEDIOL
Authors:Schuettelkopf, A.W., Hurtado-Guerrero, R., van Aalten, D.M.F.
Deposit date:2008-12-16
Release date:2009-01-27
Last modified:2012-02-08
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Molecular Mechanisms of Yeast Cell Wall Glucan Remodeling.
J.Biol.Chem., 284, 2009
2W63
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SACCHAROMYCES CEREVISIAE GAS2P IN COMPLEX WITH LAMINARITRIOSE AND LAMINARITETRAOSE
Descriptor:GLYCOLIPID-ANCHORED SURFACE PROTEIN 2, BETA-D-GLUCOSE
Authors:Schuettelkopf, A.W., Hurtado-Guerrero, R., Van Aalten, D.M.F.
Deposit date:2008-12-16
Release date:2009-01-27
Last modified:2011-09-21
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Molecular Mechanisms of Yeast Cell Wall Glucan Remodeling.
J.Biol.Chem., 284, 2009
2XTK
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CHIA1 FROM ASPERGILLUS FUMIGATUS IN COMPLEX WITH ACETAZOLAMIDE
Descriptor:CLASS III CHITINASE CHIA1, 5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE, PHOSPHATE ION
Authors:Schuettelkopf, A.W., van Aalten, D.M.F.
Deposit date:2010-10-11
Release date:2011-10-26
Last modified:2012-08-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Acetazolamide-Based Fungal Chitinase Inhibitors.
Bioorg.Med.Chem., 18, 2010
2XZ3
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BLV TM HAIRPIN
Descriptor:MALTOSE ABC TRANSPORTER PERIPLASMIC PROTEIN, ENVELOPE GLYCOPROTEIN, MALTOSE, ...
Authors:Schuettelkopf, A.W., Lamb, D., Brighty, D.W., van Aalten, D.M.F.
Deposit date:2010-11-22
Release date:2011-03-02
Last modified:2017-03-15
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Charge-Surrounded Pockets and Electrostatic Interactions with Small Ions Modulate the Activity of Retroviral Fusion Proteins.
Plos Pathog., 7, 2011
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