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5DP3
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BU of 5dp3 by Molmil
Crystal Structure of EV71 3C Proteinase in complex with compound 2
Descriptor: 3C proteinase, ethyl (4S)-5-[(3S)-2-oxopyrrolidin-3-yl]-4-[(3-phenylpropanoyl)amino]pent-2-enoate
Authors:Wu, C, Zhang, L, Li, P, Cai, Q, Peng, X, Li, N, Cai, Y, Li, J, Lin, T.
Deposit date:2015-09-12
Release date:2016-03-30
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Fragment-wise design of inhibitors to 3C proteinase from enterovirus 71
Biochim.Biophys.Acta, 1860, 2016
8AMX
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BU of 8amx by Molmil
AQP7 dimer of tetramers_D4
Descriptor: Aquaporin-7
Authors:Huang, P, Venskutonyte, R, Fan, X, Li, P, Yan, N, Gourdon, P, Lindkvist-Petersson, K.
Deposit date:2022-08-04
Release date:2023-02-15
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (2.55 Å)
Cite:Cryo-EM structure supports a role of AQP7 as a junction protein.
Nat Commun, 14, 2023
8AMW
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BU of 8amw by Molmil
AQP7 dimer of tetramers_C1
Descriptor: Aquaporin-7, GLYCEROL
Authors:Huang, P, Venskutonyte, R, Fan, X, Li, P, Yan, N, Gourdon, P, Lindkvist-Petersson, K.
Deposit date:2022-08-04
Release date:2023-02-15
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Cryo-EM structure supports a role of AQP7 as a junction protein.
Nat Commun, 14, 2023
3PYC
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BU of 3pyc by Molmil
Crystal structure of human SMURF1 C2 domain
Descriptor: CHLORIDE ION, E3 ubiquitin-protein ligase SMURF1, SULFATE ION
Authors:Li, X, Li, P.
Deposit date:2010-12-13
Release date:2011-04-06
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Crystal structure of human SMURF1 C2 domain
To be Published
2VXW
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BU of 2vxw by Molmil
Structural and Functional Studies of the Potent Anti-HIV Chemokine Variant P2-RANTES
Descriptor: C-C MOTIF CHEMOKINE 5
Authors:Jin, H, Li, P, LiWang, P.J.
Deposit date:2008-07-12
Release date:2008-07-29
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural and Functional Studies of the Potent Anti-HIV Chemokine Variant P2-Rantes.
Proteins, 78, 2010
7RCH
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BU of 7rch by Molmil
Crystal structure of NS1-ED of Vietnam influenza A virus in complex with the p85-beta-iSH2 domain of human PI3K
Descriptor: Non-structural protein 1, Phosphatidylinositol 3-kinase regulatory subunit beta
Authors:Kim, I, Zhao, B, Li, P, Cho, J.H.
Deposit date:2021-07-07
Release date:2022-07-13
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Energy landscape reshaped by strain-specific mutations underlies epistasis in NS1 evolution of influenza A virus.
Nat Commun, 13, 2022
6OX7
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BU of 6ox7 by Molmil
The complex of 1918 NS1-ED and the iSH2 domain of the human p85beta subunit of PI3K
Descriptor: Non-structural protein 1, Phosphatidylinositol 3-kinase regulatory subunit beta
Authors:Shen, Q, Zhao, B, Li, P, Cho, J.H.
Deposit date:2019-05-13
Release date:2020-04-22
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.75 Å)
Cite:Molecular recognition of a host protein by NS1 of pandemic and seasonal influenza A viruses.
Proc.Natl.Acad.Sci.USA, 117, 2020
7F6W
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BU of 7f6w by Molmil
Crystal structure of Saccharomyces cerevisiae lysyl-tRNA Synthetase
Descriptor: 1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE, 5'-O-[(L-LYSYLAMINO)SULFONYL]ADENOSINE, Lysine--tRNA ligase
Authors:Wu, S, Li, P, Hei, Z, Zheng, L, Wang, J, Fang, P.
Deposit date:2021-06-26
Release date:2022-02-16
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.607 Å)
Cite:Human lysyl-tRNA synthetase evolves a dynamic structure that can be stabilized by forming complex.
Cell.Mol.Life Sci., 79, 2022
1NW9
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BU of 1nw9 by Molmil
STRUCTURE OF CASPASE-9 IN AN INHIBITORY COMPLEX WITH XIAP-BIR3
Descriptor: Baculoviral IAP repeat-containing protein 4, ZINC ION, caspase 9, ...
Authors:Shiozaki, E.N, Chai, J, Rigotti, D.J, Riedl, S.J, Li, P, Srinivasula, S.M, Alnemri, E.S, Fairman, R, Shi, Y.
Deposit date:2003-02-05
Release date:2003-03-25
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Mechanism of XIAP-Mediated Inhibition of Caspase-9
Mol.Cell, 11, 2003
1JE6
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BU of 1je6 by Molmil
Structure of the MHC Class I Homolog MICB
Descriptor: MHC class I chain-related protein, SULFATE ION
Authors:Holmes, M.A, Li, P, Strong, R.K.
Deposit date:2001-06-15
Release date:2002-08-07
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural studies of allelic diversity of the MHC class I homolog MIC-B, a stress-inducible ligand for the activating immunoreceptor NKG2D.
J.Immunol., 169, 2002
8VVC
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BU of 8vvc by Molmil
Cryo-EM structure of human ABC transporter (hABCC1) with nucleotide-binding domain 2
Descriptor: Multidrug resistance-associated protein 1
Authors:Shinde, O, Li, P.
Deposit date:2024-01-30
Release date:2024-12-25
Last modified:2025-01-29
Method:ELECTRON MICROSCOPY (4.32 Å)
Cite:Structures of ATP-binding cassette transporter ABCC1 reveal the molecular basis of cyclic dinucleotide cGAMP export.
Immunity, 58, 2025
8VUX
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BU of 8vux by Molmil
Cryo-EM structure of human ABC transporter (hABCC1) bound to cGAMP
Descriptor: CHOLESTEROL HEMISUCCINATE, Multidrug resistance-associated protein 1, cGAMP
Authors:Shinde, O, Li, P.
Deposit date:2024-01-30
Release date:2024-12-25
Last modified:2025-01-29
Method:ELECTRON MICROSCOPY (3.54 Å)
Cite:Structures of ATP-binding cassette transporter ABCC1 reveal the molecular basis of cyclic dinucleotide cGAMP export.
Immunity, 58, 2025
3FKY
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BU of 3fky by Molmil
Crystal structure of the glutamine synthetase Gln1deltaN18 from the yeast Saccharomyces cerevisiae
Descriptor: CITRATE ANION, Glutamine synthetase
Authors:He, Y.X, Gui, L, Liu, Y.Z, Du, Y, Zhou, Y.Y, Li, P, Zhou, C.Z.
Deposit date:2008-12-18
Release date:2009-10-06
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Crystal structure of Saccharomyces cerevisiae glutamine synthetase Gln1 suggests a nanotube-like supramolecular assembly
Proteins, 76, 2009
5UL6
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BU of 5ul6 by Molmil
The molecular mechanisms by which NS1 of the 1918 Spanish influenza A virus hijack host protein-protein interactions
Descriptor: Adapter molecule crk, Proline-rich motif of nonstructural protein 1 of influenza a virus
Authors:Shen, Q, Zeng, D, Zhao, B, Li, P, Cho, J.H.
Deposit date:2017-01-24
Release date:2017-08-09
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:The Molecular Mechanisms Underlying the Hijack of Host Proteins by the 1918 Spanish Influenza Virus.
ACS Chem. Biol., 12, 2017
6U28
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BU of 6u28 by Molmil
Crystal structure of 1918 NS1-ED W187A in complex with the p85-beta-iSH2 domain of human PI3K
Descriptor: Non-structural protein 1, Phosphatidylinositol 3-kinase regulatory subunit beta
Authors:Cho, J.H, Zhao, B, Savage, N, Li, P.
Deposit date:2019-08-19
Release date:2020-04-22
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Molecular recognition of a host protein by NS1 of pandemic and seasonal influenza A viruses.
Proc.Natl.Acad.Sci.USA, 117, 2020
7RMU
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BU of 7rmu by Molmil
Structure of Thermomonospora curvata heme-containing DyP-type peroxidase with a modified axial ligand
Descriptor: DyP-type Peroxidase, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION
Authors:Khadka, S, Li, P, Geisbrecht, B.V.
Deposit date:2021-07-28
Release date:2022-08-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structure of Thermomonospora curvata heme-containing DyP-type peroxidase with a modified axial ligand
To Be Published
6V42
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BU of 6v42 by Molmil
Crystal structure of the flavin oxygenase with cofactor bound involved in folate catabolism
Descriptor: FAD/FMN-containing dehydrogenase, FLAVIN-ADENINE DINUCLEOTIDE
Authors:Begley, T.P, Adak, S, Zhao, B, Li, P.
Deposit date:2019-11-27
Release date:2020-12-02
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:A novel flavoenzyme catalyzed Baeyer-Villiger type rearrangement in bacterial folic acid catabolic pathway
To Be Published
6V43
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BU of 6v43 by Molmil
Crystal structure of the flavin oxygenase with cofactor and substrate bound involved in folate catabolism
Descriptor: FAD/FMN-containing dehydrogenase, FLAVIN-ADENINE DINUCLEOTIDE, pteridine-2,4(1H,3H)-dione
Authors:Begley, T.P, Adak, S, Zhao, B, Li, P.
Deposit date:2019-11-27
Release date:2020-12-09
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:A novel flavoenzyme catalyzed Baeyer-Villiger type rearrangement in bacterial folic acid catabolic pathway
To Be Published
6ASL
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BU of 6asl by Molmil
Crystal Structure of Flavin monooxygenase CmoJ (earlier YtnJ) bound with FMN
Descriptor: FLAVIN MONONUCLEOTIDE, LUMIFLAVIN, Putative monooxygenase MoxC
Authors:Bhandari, D.M, Zhao, B, Li, P, Begley, T.P.
Deposit date:2017-08-24
Release date:2018-09-12
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Flavin mediated Pummerer type rearrangement in cysteine salvage pathway
To Be Published
6ODB
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BU of 6odb by Molmil
Crystal structure of HDAC8 in complex with compound 3
Descriptor: GLYCEROL, Histone deacetylase 8, N-{2-[(1E)-3-(hydroxyamino)-3-oxoprop-1-en-1-yl]phenyl}-2-phenoxybenzamide, ...
Authors:Zheng, X, Conti, C, Caravella, J, Zablocki, M.-M, Bair, K, Barczak, N, Han, B, Lancia Jr, D, Liu, C, Martin, M, Ng, P.Y, Rudnitskaya, A, Thomason, J.J, Garcia-Dancey, R, Hardy, C, Lahdenranta, J, Leng, C, Li, P, Pardo, E, Saldahna, A, Tan, T, Toms, A.V, Yao, L, Zhang, C.
Deposit date:2019-03-26
Release date:2020-04-01
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure-based Discovery of Novel N-(E)-N-Hydroxy-3-(2-(2-oxoimidazolidin-1-yl)phenyl)acrylamides as Potent and Selective HDAC8 inhibitors
To Be Published
6ASK
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BU of 6ask by Molmil
Crystal Structure of apo Flavin monooxygenase CmoJ (earlier YtnJ)
Descriptor: Putative monooxygenase MoxC
Authors:Bhandari, D.M, Zhao, B, Li, P, Begley, T.P.
Deposit date:2017-08-24
Release date:2018-08-29
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Flavin mediated Pummerer type rearrangement in cysteine salvage pathway
To Be Published
1QZ2
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BU of 1qz2 by Molmil
Crystal Structure of FKBP52 C-terminal Domain complex with the C-terminal peptide MEEVD of Hsp90
Descriptor: 5-mer peptide from Heat shock protein HSP 90, FK506-binding protein 4
Authors:Wu, B, Li, P, Lou, Z, Liu, Y, Ding, Y, Shu, C, Shen, B, Rao, Z.
Deposit date:2003-09-15
Release date:2004-06-22
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (3 Å)
Cite:3D structure of human FK506-binding protein 52: Implications for the assembly of the glucocorticoid receptor/Hsp90/immunophilin heterocomplex.
Proc.Natl.Acad.Sci.USA, 101, 2004
1SVS
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BU of 1svs by Molmil
Structure of the K180P mutant of Gi alpha subunit bound to GppNHp.
Descriptor: Guanine nucleotide-binding protein G(i), alpha-1 subunit, MAGNESIUM ION, ...
Authors:Thomas, C.J, Du, X, Li, P, Wang, Y, Ross, E.M, Sprang, S.R.
Deposit date:2004-03-29
Release date:2004-06-01
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Uncoupling conformational change from GTP hydrolysis in a heterotrimeric G protein {alpha}-subunit.
Proc.Natl.Acad.Sci.USA, 101, 2004
8VT4
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BU of 8vt4 by Molmil
Cryo-EM structure of human ABC transporter ABCC1
Descriptor: CHOLESTEROL HEMISUCCINATE, Multidrug resistance-associated protein 1
Authors:Shinde, O, Li, P.
Deposit date:2024-01-25
Release date:2024-12-25
Last modified:2025-01-29
Method:ELECTRON MICROSCOPY (3.79 Å)
Cite:Structures of ATP-binding cassette transporter ABCC1 reveal the molecular basis of cyclic dinucleotide cGAMP export.
Immunity, 58, 2025
5JEK
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BU of 5jek by Molmil
Phosphorylated MAVS in complex with IRF-3
Descriptor: Interferon regulatory factor 3, MAVS peptide
Authors:Zhao, B, Li, P.
Deposit date:2016-04-18
Release date:2016-06-15
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural basis for concerted recruitment and activation of IRF-3 by innate immune adaptor proteins.
Proc.Natl.Acad.Sci.USA, 113, 2016

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PDB entries from 2025-07-23

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