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4KCX
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BU of 4kcx by Molmil
BRDT in complex with Dinaciclib
Descriptor: 3-[({3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl}amino)methyl]-1-hydroxypyridinium, Bromodomain testis-specific protein, CHLORIDE ION
Authors:Martin, M.P, Schonbrunn, E.
Deposit date:2013-04-24
Release date:2013-09-18
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Cyclin-dependent kinase inhibitor dinaciclib interacts with the acetyl-lysine recognition site of bromodomains.
Acs Chem.Biol., 8, 2013
4KD1
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BU of 4kd1 by Molmil
CDK2 in complex with Dinaciclib
Descriptor: 1,2-ETHANEDIOL, 3-[({3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl}amino)methyl]-1-hydroxypyridinium, Cyclin-dependent kinase 2
Authors:Martin, M.P, Schonbrunn, E.
Deposit date:2013-04-24
Release date:2013-09-18
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Cyclin-dependent kinase inhibitor dinaciclib interacts with the acetyl-lysine recognition site of bromodomains.
Acs Chem.Biol., 8, 2013
4KD3
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BU of 4kd3 by Molmil
Crystal structure of Staphylococcal nuclease variant Delta+PHS L25A/V66A/I92A at cryogenic temperature
Descriptor: CALCIUM ION, THYMIDINE-3',5'-DIPHOSPHATE, Thermonuclease
Authors:Caro, J.A, Schlessman, J.L, Heroux, A, Garcia-Moreno E, B.
Deposit date:2013-04-24
Release date:2013-05-08
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Pressure effects in proteins
To be Published
4KD4
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BU of 4kd4 by Molmil
Crystal structure of Staphylococcal nuclease variant V23L/L25V/V66I/I72V at cryogenic temperature
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, CALCIUM ION, PHOSPHATE ION, ...
Authors:Caro, J.A, Flores, E, Schlessman, J.L, Heroux, A, Garcia-Moreno E, B.
Deposit date:2013-04-24
Release date:2013-05-08
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Pressure effects in proteins
To be Published
4KD5
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BU of 4kd5 by Molmil
substrate binding domain of putative molybdenum ABC transporter from Clostridium difficile
Descriptor: 2-BUTANOL, ABC-type transport system, molybdenum-specific extracellular solute-binding protein, ...
Authors:Maltseva, N, Kim, Y, Grimshaw, S, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2013-04-24
Release date:2013-05-08
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.4999 Å)
Cite:Substrate binding domain of putative molybdenum ABC transporter from Clostridium difficile 630
TO BE PUBLISHED
4KD6
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BU of 4kd6 by Molmil
Crystal structure of a Enoyl-CoA hydratase/isomerase from Burkholderia graminis C4D1M
Descriptor: Enoyl-CoA hydratase/isomerase
Authors:Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Al Obaidi, N, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC)
Deposit date:2013-04-24
Release date:2013-07-24
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Crystal structure of a Enoyl-CoA hydratase/isomerase from Burkholderia graminis C4D1M
To be Published
4KD7
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BU of 4kd7 by Molmil
Human dihydrofolate reductase complexed with NADPH and 5-{3-[3-methoxy-5(pyridine-4-yl)phenyl]prop-1-yn-1-yl}-6-ethyl-pyrimidine-2,4-diamine
Descriptor: 6-ethyl-5-{3-[3-methoxy-5-(pyridin-4-yl)phenyl]prop-1-yn-1-yl}pyrimidine-2,4-diamine, Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Lamb, K.M, Anderson, A.C.
Deposit date:2013-04-24
Release date:2013-10-09
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.715 Å)
Cite:Elucidating features that drive the design of selective antifolates using crystal structures of human dihydrofolate reductase.
Biochemistry, 52, 2013
4KDC
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BU of 4kdc by Molmil
Crystal Structure of UBIG
Descriptor: 3-demethylubiquinone-9 3-methyltransferase
Authors:Zhu, Y, Teng, M, Li, X.
Deposit date:2013-04-24
Release date:2014-04-30
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Structural and biochemical studies reveal UbiG/Coq3 as a class of novel membrane-binding proteins.
Biochem. J., 470, 2015
4KDD
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BU of 4kdd by Molmil
Structure of Mycobacterium tuberculosis ribosome recycling factor in presence of detergent
Descriptor: CADMIUM ION, DECYL-BETA-D-MALTOPYRANOSIDE, Ribosome-recycling factor
Authors:Selvaraj, M, Govindan, A, Seshadri, A, Dubey, B, Varshney, U, Vijayan, M.
Deposit date:2013-04-24
Release date:2014-03-12
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Molecular flexibility of Mycobacterium tuberculosis ribosome recycling factor and its functional consequences: an exploration involving mutants.
J.Biosci., 38, 2013
4KDE
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BU of 4kde by Molmil
Crystal Structure of the Apo Form of Thermus thermophilus Malate Dehydrogenase
Descriptor: Malate dehydrogenase
Authors:Hsu, C.-H, Hong, C.-H, Chang, Y.-Y.
Deposit date:2013-04-25
Release date:2014-02-05
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.798 Å)
Cite:Crystal structures and molecular dynamics simulations of thermophilic malate dehydrogenase reveal critical loop motion for co-substrate binding.
Plos One, 8, 2013
4KDF
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BU of 4kdf by Molmil
Crystal Structure of Thermus thermophilus Malate Dehydrogenase in Complex with NAD
Descriptor: Malate dehydrogenase, SULFATE ION
Authors:Hsu, C.-H, Hong, C.-H, Chang, Y.-Y.
Deposit date:2013-04-25
Release date:2014-02-05
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.356 Å)
Cite:Crystal structures and molecular dynamics simulations of thermophilic malate dehydrogenase reveal critical loop motion for co-substrate binding.
Plos One, 8, 2013
4KDI
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BU of 4kdi by Molmil
Crystal structure of p97/VCP N in complex with OTU1 UBXL
Descriptor: Transitional endoplasmic reticulum ATPase, Ubiquitin thioesterase OTU1
Authors:Kim, S.J, Kim, E.E.
Deposit date:2013-04-25
Release date:2014-03-19
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Structural Basis for Ovarian Tumor Domain-containing Protein 1 (OTU1) Binding to p97/Valosin-containing Protein (VCP).
J.Biol.Chem., 289, 2014
4KDL
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BU of 4kdl by Molmil
Crystal structure of p97/VCP N in complex with OTU1 UBXL
Descriptor: Transitional endoplasmic reticulum ATPase, Ubiquitin thioesterase OTU1
Authors:Kim, S.J, Kim, E.E.
Deposit date:2013-04-25
Release date:2014-03-19
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Structural Basis for Ovarian Tumor Domain-containing Protein 1 (OTU1) Binding to p97/Valosin-containing Protein (VCP).
J.Biol.Chem., 289, 2014
4KDM
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BU of 4kdm by Molmil
Crystal structure of the hemagglutinin of ferret-transmissible H5N1 virus
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin
Authors:Lu, X, Shi, Y, Zhang, W, Zhang, Y, Qi, J, Gao, G.F.
Deposit date:2013-04-25
Release date:2013-07-24
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.496 Å)
Cite:Structure and receptor-binding properties of an airborne transmissible avian influenza A virus hemagglutinin H5 (VN1203mut).
Protein Cell, 4, 2013
4KDN
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BU of 4kdn by Molmil
Crystal structure of the hemagglutinin of ferret-transmissible H5N1 virus in complex with avian receptor analog LSTa
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
Authors:Lu, X, Shi, Y, Zhang, W, Zhang, Y, Qi, J, Gao, G.F.
Deposit date:2013-04-25
Release date:2013-07-24
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.483 Å)
Cite:Structure and receptor-binding properties of an airborne transmissible avian influenza A virus hemagglutinin H5 (VN1203mut).
Protein Cell, 4, 2013
4KDO
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BU of 4kdo by Molmil
Crystal structure of the hemagglutinin of ferret-transmissible H5N1 virus in complex with human receptor analog LSTc
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
Authors:Lu, X, Shi, Y, Zhang, W, Zhang, Y, Qi, J, Gao, G.F.
Deposit date:2013-04-25
Release date:2013-07-24
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.396 Å)
Cite:Structure and receptor-binding properties of an airborne transmissible avian influenza A virus hemagglutinin H5 (VN1203mut).
Protein Cell, 4, 2013
4KDP
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BU of 4kdp by Molmil
TcaR-ssDNA complex crystal structure reveals the novel ssDNA binding mechanism of the MarR family proteins
Descriptor: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DNA (5'-D(*CP*GP*CP*AP*GP*CP*GP*CP*GP*CP*AP*GP*CP*CP*CP*TP*A)-3'), ...
Authors:Chang, Y.M, Chen, C.K.-M, Wang, A.H.-J.
Deposit date:2013-04-25
Release date:2014-03-19
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (3.6 Å)
Cite:TcaR-ssDNA complex crystal structure reveals new DNA binding mechanism of the MarR family proteins.
Nucleic Acids Res., 42, 2014
4KDQ
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BU of 4kdq by Molmil
Crystal structure of the hemagglutinin of A/Xinjiang/1/2006 virus
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin
Authors:Lu, X, Shi, Y, Zhang, W, Zhang, Y, Qi, J, Gao, G.F.
Deposit date:2013-04-25
Release date:2013-07-24
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.604 Å)
Cite:Structure and receptor-binding properties of an airborne transmissible avian influenza A virus hemagglutinin H5 (VN1203mut).
Protein Cell, 4, 2013
4KDR
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BU of 4kdr by Molmil
Crystal Structure of UBIG/SAH complex
Descriptor: 3-demethylubiquinone-9 3-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
Authors:Zhu, Y, Teng, M, Li, X.
Deposit date:2013-04-25
Release date:2014-04-30
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.003 Å)
Cite:Crystal Structure of the UBIG/SAH complex
To be Published
4KDS
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BU of 4kds by Molmil
Crystal structure of latent rainbow trout plasminogen activator inhibitor 1 (PAI-1)
Descriptor: Plasminogen activator inhibitor 1, SULFATE ION
Authors:Johansen, J.S.
Deposit date:2013-04-25
Release date:2013-05-22
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.6682 Å)
Cite:Protein conformational change delayed by steric hindrance from an N-linked glycan.
J.Mol.Biol., 425, 2013
4KDT
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BU of 4kdt by Molmil
Structure of an early native-like intermediate of beta2-microglobulin amyloidosis
Descriptor: Beta-2-microglobulin, GLYCEROL, Nanobody24, ...
Authors:Vanderhaegen, S, Fislage, M, Pardon, E, Versees, W, Steyaert, J.
Deposit date:2013-04-25
Release date:2013-08-28
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure of an early native-like intermediate of beta 2-microglobulin amyloidogenesis.
Protein Sci., 22, 2013
4KDU
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BU of 4kdu by Molmil
Crystal structure of a glutathione transferase family member from Burkholderia graminis, target efi-507264, no gsh, ordered domains, space group P21, form(1)
Descriptor: Glutathione S-transferase domain
Authors:Vetting, M.W, Toro, R, Bhosle, R, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Stead, M, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Gerlt, J.A, Armstrong, R.N, Almo, S.C, Enzyme Function Initiative (EFI)
Deposit date:2013-04-25
Release date:2013-05-08
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of a glutathione transferase family member from Burkholderia graminis, target efi-507264, no gsh, ordered domains, space group P21, form(1)
To be Published
4KDV
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BU of 4kdv by Molmil
Crystal structure of a bacterial immunoglobulin-like domain from the M. primoryensis ice-binding adhesin
Descriptor: Antifreeze protein, CALCIUM ION
Authors:Guo, S, Garnham, C.P, Karunan, S.P, Campbell, R.L, Allingham, J.S, Davies, P.L.
Deposit date:2013-04-25
Release date:2013-10-02
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.42 Å)
Cite:Role of Ca(2+) in folding the tandem beta-sandwich extender domains of a bacterial ice-binding adhesin.
Febs J., 280, 2013
4KDW
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BU of 4kdw by Molmil
Crystal structure of a bacterial immunoglobulin-like domain from the M. primoryensis ice-binding adhesin
Descriptor: Antifreeze protein, CALCIUM ION, GLYCEROL
Authors:Guo, S, Garnham, C.P, Karunan, S.P, Campbell, R.L, Allingham, J.S, Davies, P.L.
Deposit date:2013-04-25
Release date:2013-10-02
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Role of Ca(2+) in folding the tandem beta-sandwich extender domains of a bacterial ice-binding adhesin.
Febs J., 280, 2013
4KDX
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BU of 4kdx by Molmil
Crystal structure of a glutathione transferase family member from burkholderia graminis, target efi-507264, bound gsh, ordered domains, space group p21, form(1)
Descriptor: GLUTATHIONE, GLYCEROL, Glutathione S-transferase domain
Authors:Vetting, M.W, Toro, R, Bhosle, R, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Stead, M, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Gerlt, J.A, Armstrong, R.N, Almo, S.C, Enzyme Function Initiative (EFI)
Deposit date:2013-04-25
Release date:2013-05-08
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Crystal structure of a glutathione transferase family member from burkholderia graminis, target efi-507264, bound gsh, ordered domains, space group P21, form(1)
To be Published

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