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3U3D
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BU of 3u3d by Molmil
Plasmodium falciparum Sir2A preferentially hydrolyzes medium and long chain fatty acyl lysine
Descriptor: GLYCEROL, Transcriptional regulatory protein sir2 homologue, ZINC ION, ...
Authors:Zhou, Y, Hao, Q.
Deposit date:2011-10-05
Release date:2011-11-09
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Plasmodium falciparum Sir2A Preferentially Hydrolyzes Medium and Long Chain Fatty Acyl Lysine
Acs Chem.Biol., 2011
3TKM
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BU of 3tkm by Molmil
Crystal structure PPAR delta binding GW0742
Descriptor: GLYCEROL, Peroxisome proliferator-activated receptor delta, {4-[({2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl}methyl)sulfanyl]-2-methylphenoxy}acetic acid
Authors:Trivella, D.B.B, Batista, F.H, Polikarpov, I.
Deposit date:2011-08-27
Release date:2012-07-04
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.953 Å)
Cite:Structural Insights into Human Peroxisome Proliferator Activated Receptor Delta (PPAR-Delta) Selective Ligand Binding.
Plos One, 7, 2012
1SYL
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BU of 1syl by Molmil
Crystal structure of inactive mutant dUTPase complexed with substrate dUTP
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, DEOXYURIDINE-5'-TRIPHOSPHATE, Deoxyuridine 5'-triphosphate nucleotidohydrolase, ...
Authors:Barabas, O, Kovari, J, Pongracz, V, Wilmanns, M, Vertessy, B.G.
Deposit date:2004-04-01
Release date:2004-09-07
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural Insights into the Catalytic Mechanism of Phosphate Ester Hydrolysis by dUTPase
J.Biol.Chem., 279, 2004
1WSG
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BU of 1wsg by Molmil
Co-crystal structure of E.coli RNase HI active site mutant (E48A/D134N*) with Mn2+
Descriptor: MANGANESE (II) ION, Ribonuclease HI
Authors:Tsunaka, Y, Takano, K, Matsumura, H, Yamagata, Y, Kanaya, S.
Deposit date:2004-11-05
Release date:2005-02-08
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Identification of Single Mn(2+) Binding Sites Required for Activation of the Mutant Proteins of E.coli RNase HI at Glu48 and/or Asp134 by X-ray Crystallography
J.Mol.Biol., 345, 2005
3TW2
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BU of 3tw2 by Molmil
High resolution structure of human histidine triad nucleotide-binding protein 1 (hHINT1)/AMP complex in a monoclinic space group
Descriptor: ADENOSINE MONOPHOSPHATE, Histidine triad nucleotide-binding protein 1
Authors:Dolot, R.M, Wlodarczyk, A, Ozga, M, Krakowiak, A, Nawrot, B.
Deposit date:2011-09-21
Release date:2011-11-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:A new crystal form of human histidine triad nucleotide-binding protein 1 (hHINT1) in complex with adenosine 5'-monophosphate at 1.38 A resolution.
Acta Crystallogr.,Sect.F, 68, 2012
1WSH
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BU of 1wsh by Molmil
Crystal structure of E.coli RNase HI active site mutant (E48A/K87A)
Descriptor: Ribonuclease HI
Authors:Tsunaka, Y, Takano, K, Matsumura, H, Yamagata, Y, Kanaya, S.
Deposit date:2004-11-07
Release date:2004-11-23
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:

1WTH
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BU of 1wth by Molmil
Crystal structure of gp5-S351L mutant and gp27 complex
Descriptor: Baseplate structural protein Gp27, PHOSPHATE ION, POTASSIUM ION, ...
Authors:Kanamaru, S, Ishiwata, Y, Suzuki, T, Rossmann, M.G, Arisaka, F.
Deposit date:2004-11-23
Release date:2005-03-08
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Control of bacteriophage t4 tail lysozyme activity during the infection process
J.Mol.Biol., 346, 2005
1WSI
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BU of 1wsi by Molmil
Crystal structure of E.coli RNase HI active site mutant (E48A/K87A/D134N)
Descriptor: Ribonuclease HI
Authors:Tsunaka, Y, Takano, K, Matsumura, H, Yamagata, Y, Kanaya, S.
Deposit date:2004-11-07
Release date:2004-11-23
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:

3HGY
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BU of 3hgy by Molmil
Crystal Structure of CmeR Bound to Taurocholic Acid
Descriptor: CmeR, TAUROCHOLIC ACID
Authors:Routh, M.D, Yang, F.
Deposit date:2009-05-14
Release date:2010-06-30
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.416 Å)
Cite:Structural basis for anionic ligand recognition by multidrug binding proteins: crystal structures of CmeR-bile acid complexes
To be Published
1WSJ
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BU of 1wsj by Molmil
Crystal structure of E.coli RNase HI active site mutant (K87A/H124A)
Descriptor: Ribonuclease HI
Authors:Tsunaka, Y, Takano, K, Matsumura, H, Yamagata, Y, Kanaya, S.
Deposit date:2004-11-07
Release date:2004-11-23
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:

3R8D
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BU of 3r8d by Molmil
Activation of the Human Nuclear Xenobiotic Receptor PXR by the Reverse Transcriptase-Targeted Anti-HIV Drug PNU-142721
Descriptor: 6-CHLORO-2-(1-FURO[2,3-C]PYRIDIN-5-YL-ETHYLSULFANYL)-PYRIMIDIN-4-YLAMINE, Nuclear receptor subfamily 1 group I member 2
Authors:Cheng, Y, Redinbo, M.R.
Deposit date:2011-03-23
Release date:2011-08-17
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Activation of the human nuclear xenobiotic receptor PXR by the reverse transcriptase-targeted anti-HIV drug PNU-142721.
Protein Sci., 20, 2011
2KHQ
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BU of 2khq by Molmil
Solution NMR structure of a phage integrase SSP1947 fragment 59-159 from Staphylococcus saprophyticus, Northeast Structural Genomics Consortium Target SyR103B
Descriptor: Integrase
Authors:Eletsky, A, Mills, J.L, Hua, J, Belote, R.L, Ciccosanti, C, Jiang, M, Nair, R, Rost, B, Acton, T.B, Xiao, R, Swapna, G.V.T, Everett, J.K, Montelione, G.T, Szyperski, T, Northeast Structural Genomics Consortium (NESG)
Deposit date:2009-04-10
Release date:2009-04-28
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution NMR structure of a phage integrase SSP1947 fragment 59-159 from Staphylococcus saprophyticus
To be Published
2LWF
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BU of 2lwf by Molmil
Structure of N-terminal domain of a plant Grx
Descriptor: Monothiol glutaredoxin-S16, chloroplastic
Authors:Feng, Y.
Deposit date:2012-07-28
Release date:2013-05-22
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Structural insights into the N-terminal GIY-YIG endonuclease activity of Arabidopsis glutaredoxin AtGRXS16 in chloroplasts.
Proc.Natl.Acad.Sci.USA, 110, 2013
8VMB
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BU of 8vmb by Molmil
The crystal structure of rhinovirus C15 RNA replication element sB-loop mutant in complex with Fab BL3-6
Descriptor: Heavy Chain of Fab BL3-6, Light Chain of Fab BL3-6, RNA (83-MER)
Authors:Das, N.K, Koirala, D.
Deposit date:2024-01-13
Release date:2024-07-24
Last modified:2024-08-07
Method:X-RAY DIFFRACTION (2.97 Å)
Cite:Structural basis for a highly conserved RNA-mediated enteroviral genome replication.
Nucleic Acids Res., 2024
8XBS
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BU of 8xbs by Molmil
C. elegans apo-SID1 structure
Descriptor: (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Gong, D.S.
Deposit date:2023-12-07
Release date:2024-06-05
Last modified:2024-07-03
Method:ELECTRON MICROSCOPY (2.21 Å)
Cite:Structural basis for double-stranded RNA recognition by SID1.
Nucleic Acids Res., 52, 2024
8XC1
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BU of 8xc1 by Molmil
C. elegans SID1 in complex with dsRNA
Descriptor: (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Gong, D.S.
Deposit date:2023-12-07
Release date:2024-06-05
Last modified:2024-07-03
Method:ELECTRON MICROSCOPY (2.21 Å)
Cite:Structural basis for double-stranded RNA recognition by SID1.
Nucleic Acids Res., 52, 2024
9FEH
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BU of 9feh by Molmil
Crystal structure of SARS-CoV-2 nsp14 methyltransferase domain in complex with the STM957 inhibitor
Descriptor: Transcription factor ETV6,Guanine-N7 methyltransferase nsp14, ZINC ION, ~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[4-azanyl-5-(2-pyridin-3-ylethynyl)pyrrolo[2,3-d]pyrimidin-7-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3-cyano-~{N}-ethyl-4-methoxy-benzenesulfonamide
Authors:Zilecka, E, Klima, M, Boura, E.
Deposit date:2024-05-20
Release date:2024-08-28
Last modified:2024-09-04
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Structure of SARS-CoV-2 MTase nsp14 with the inhibitor STM957 reveals inhibition mechanism that is shared with a poxviral MTase VP39.
J Struct Biol X, 10, 2024
8W9A
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BU of 8w9a by Molmil
CryoEM structure of human PI3K-alpha (P85/P110-H1047R) with QR-7909 binding at an allosteric site
Descriptor: 6-chloranyl-3-[[(1R)-1-[2-(1,3-dihydropyrrolo[3,4-c]pyridin-2-yl)-3,6-dimethyl-4-oxidanylidene-quinazolin-8-yl]ethyl]amino]pyridine-2-carboxylic acid, Phosphatidylinositol 3-kinase regulatory subunit alpha, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
Authors:Huang, X, Ren, X, Zhong, W.
Deposit date:2023-09-05
Release date:2024-04-17
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Cryo-EM structures reveal two allosteric inhibition modes of PI3K alpha H1047R involving a re-shaping of the activation loop.
Structure, 32, 2024
8VSU
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BU of 8vsu by Molmil
Cryo-EM structure of LKB1-STRADalpha-MO25alpha heterocomplex
Descriptor: ADENOSINE-5'-DIPHOSPHATE, Calcium-binding protein 39, Isoform 3 of STE20-related kinase adapter protein alpha, ...
Authors:Chan, L.M, Courteau, B.J, Verba, K.A.
Deposit date:2024-01-24
Release date:2024-07-10
Last modified:2024-07-17
Method:ELECTRON MICROSCOPY (2.86 Å)
Cite:High-resolution single-particle imaging at 100-200 keV with the Gatan Alpine direct electron detector.
J.Struct.Biol., 216, 2024
8WMS
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BU of 8wms by Molmil
Crystal structure of human DPPA3 in complex with human UHRF1 PHD domain
Descriptor: Developmental pluripotency-associated protein 3, E3 ubiquitin-protein ligase UHRF1, ZINC ION
Authors:Shiraishi, N, Arita, K.
Deposit date:2023-10-04
Release date:2024-07-31
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of human DPPA3 in complex with human UHRF1 PHD domain
To Be Published
8XB3
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BU of 8xb3 by Molmil
Structural mechanism of substrate binding and inhibition of the human Norepinephrine Transporter
Descriptor: 1-[(3-iodanylphenyl)methyl]guanidine, 2-acetamido-2-deoxy-beta-D-glucopyranose, GFP-MBP-solute carrier family 6 member 2
Authors:Ji, W.M, Wu, J.X.
Deposit date:2023-12-05
Release date:2024-06-26
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Substrate binding and inhibition mechanism of norepinephrine transporter.
Nature, 633, 2024
8VM8
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BU of 8vm8 by Molmil
The crystal structure of coxsackievirus B3 RNA replication element sD-loop mutant in complex with Fab BL3-6
Descriptor: Heavy Chain of Fab BL3-6, Light Chain of Fab BL3-6, RNA (93-MER)
Authors:Das, N.K, Koirala, D.
Deposit date:2024-01-13
Release date:2024-07-24
Last modified:2024-08-07
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Structural basis for a highly conserved RNA-mediated enteroviral genome replication.
Nucleic Acids Res., 2024
8WIK
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BU of 8wik by Molmil
Crystal structure of human FSP1
Descriptor: 6-HYDROXY-FLAVIN-ADENINE DINUCLEOTIDE, Ferroptosis suppressor protein 1, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Feng, S, Huang, X, Tang, D, Qi, S.
Deposit date:2023-09-24
Release date:2024-05-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:The crystal structure of human ferroptosis suppressive protein 1 in complex with flavin adenine dinucleotide and nicotinamide adenine nucleotide.
MedComm (2020), 5, 2024
8XB4
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BU of 8xb4 by Molmil
Structure of apo state of the human Norepinephrine Transporter
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, GFP-MBP-solute carrier family 6 member 2
Authors:Wu, J.X, Ji, W.M.
Deposit date:2023-12-05
Release date:2024-06-26
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (2.92 Å)
Cite:Substrate binding and inhibition mechanism of norepinephrine transporter.
Nature, 633, 2024
4L59
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BU of 4l59 by Molmil
Crystal structure of the 3-MBT repeat domain of L3MBTL3 and UNC2533 complex
Descriptor: 4-(pyrrolidin-1-yl)-1-{4-[2-(pyrrolidin-1-yl)ethyl]phenyl}piperidine, Lethal(3)malignant brain tumor-like protein 3, SULFATE ION, ...
Authors:Zhong, N, Dong, A, Ravichandran, M, Camerino, M.A, Dickson, B.M, James, L.I, Baughman, B.M, Norris, J.L, Kireev, D.B, Janzen, W.P, Graslund, S, Frye, S.V, Bountra, C, Edwards, A.M, Arrowsmith, C.H, Brown, P.J, Structural Genomics Consortium (SGC)
Deposit date:2013-06-10
Release date:2013-07-10
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:The structure-activity relationships of L3MBTL3 inhibitors: flexibility of the dimer interface.
Medchemcomm, 4, 2013

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数据于2024-10-16公开中

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