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8Y8D
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BU of 8y8d by Molmil
Structure of HCoV-HKU1C spike in the inactive-1up conformation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein, ...
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-10-16
Method:ELECTRON MICROSCOPY (3.41 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
8Y8I
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BU of 8y8i by Molmil
Structure of HCoV-HKU1C spike in the glycan-activated-3up conformation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-10-23
Method:ELECTRON MICROSCOPY (3.58 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
8Y8C
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BU of 8y8c by Molmil
Structure of HCoV-HKU1C spike in the inactive-closed conformation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-08-28
Method:ELECTRON MICROSCOPY (2.95 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
6LLC
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BU of 6llc by Molmil
Discovery of A Dual Inhibitor of NQO1 and GSTP1 for Treating Malignant Glioblastoma
Descriptor: 5-methyl-N-(5-nitro-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide, FLAVIN-ADENINE DINUCLEOTIDE, NAD(P)H dehydrogenase [quinone] 1, ...
Authors:Ye, K, Li, H.
Deposit date:2019-12-23
Release date:2020-11-25
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.501 Å)
Cite:Discovery of a dual inhibitor of NQO1 and GSTP1 for treating glioblastoma.
J Hematol Oncol, 13, 2020
8Y8F
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BU of 8y8f by Molmil
Structure of HCoV-HKU1C spike in the glycan-activated-closed conformation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein, ...
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-11-13
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
8Y8H
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BU of 8y8h by Molmil
Structure of HCoV-HKU1C spike in the glycan-activated-2up conformation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-11-06
Method:ELECTRON MICROSCOPY (3.65 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
8Y8J
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BU of 8y8j by Molmil
Local structure of HCoV-HKU1C spike in complex with glycan
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein, ...
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-10-23
Method:ELECTRON MICROSCOPY (3.57 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
8Y8G
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BU of 8y8g by Molmil
Structure of HCoV-HKU1C spike in the glycan-activated-1up conformation
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein, ...
Authors:Lu, Y.C, Zhang, X, Wang, H.F, Sun, L, Yang, H.T.
Deposit date:2024-02-06
Release date:2024-07-17
Last modified:2024-11-06
Method:ELECTRON MICROSCOPY (3.23 Å)
Cite:TMPRSS2 and glycan receptors synergistically facilitate coronavirus entry.
Cell, 187, 2024
7XTV
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BU of 7xtv by Molmil
The structure of MHET-bound TfCut S130A
Descriptor: 4-(2-hydroxyethyloxycarbonyl)benzoic acid, ACETATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Yang, Y, Jiang, P.C, Huang, J.-W, Chen, C.-C, Guo, R.-T.
Deposit date:2022-05-18
Release date:2023-03-29
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Complete bio-degradation of poly(butylene adipate-co-terephthalate) via engineered cutinases.
Nat Commun, 14, 2023
7XTU
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BU of 7xtu by Molmil
The structure of TfCut S130A
Descriptor: ACETATE ION, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
Authors:Yang, Y, Jiang, P.C, Huang, J.-W, Chen, C.-C, Guo, R.-T.
Deposit date:2022-05-18
Release date:2023-03-29
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Complete bio-degradation of poly(butylene adipate-co-terephthalate) via engineered cutinases.
Nat Commun, 14, 2023
7XTW
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BU of 7xtw by Molmil
The structure of IsPETase in complex with MHET
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-(2-hydroxyethyloxycarbonyl)benzoic acid, GLYCEROL, ...
Authors:Yang, Y, Jiang, P.C, Huang, J.-W, Chen, C.-C, Guo, R.-T.
Deposit date:2022-05-18
Release date:2023-03-29
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Complete bio-degradation of poly(butylene adipate-co-terephthalate) via engineered cutinases.
Nat Commun, 14, 2023
7XTR
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BU of 7xtr by Molmil
The apo structure of the engineered TfCut
Descriptor: GLYCEROL, LITHIUM ION, SULFATE ION, ...
Authors:Yang, Y, Jiang, P.C, Huang, J.-W, Chen, C.-C, Guo, R.-T.
Deposit date:2022-05-18
Release date:2023-03-29
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Complete bio-degradation of poly(butylene adipate-co-terephthalate) via engineered cutinases.
Nat Commun, 14, 2023
7XTS
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BU of 7xts by Molmil
The apo structure of the engineered TfCut S130A
Descriptor: SODIUM ION, alpha/beta hydrolase
Authors:Yang, Y, Jiang, P.C, Huang, J.-W, Chen, C.-C, Guo, R.-T.
Deposit date:2022-05-18
Release date:2023-03-29
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.21 Å)
Cite:Complete bio-degradation of poly(butylene adipate-co-terephthalate) via engineered cutinases.
Nat Commun, 14, 2023
7XTT
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BU of 7xtt by Molmil
The structure of engineered TfCut S130A in complex with MHET
Descriptor: 1,2-ETHANEDIOL, 4-(2-hydroxyethyloxycarbonyl)benzoic acid, SODIUM ION, ...
Authors:Yang, Y, Jiang, P.C, Huang, J.W, Chen, C.-C, Guo, R.-T.
Deposit date:2022-05-18
Release date:2023-03-29
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Complete bio-degradation of poly(butylene adipate-co-terephthalate) via engineered cutinases.
Nat Commun, 14, 2023
4JOO
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BU of 4joo by Molmil
Spirocyclic Beta-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitors
Descriptor: (4R)-2'-amino-6-bromo-1',2,2-trimethyl-2,3-dihydrospiro[chromene-4,4'-imidazol]-5'(1'H)-one, Beta-secretase 1, NICKEL (II) ION
Authors:Vigers, G.P.A, Smith, D.
Deposit date:2013-03-18
Release date:2013-04-10
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Spirocyclic beta-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors: from hit to lowering of cerebrospinal fluid (CSF) amyloid beta in a higher species.
J.Med.Chem., 56, 2013
4JG4
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BU of 4jg4 by Molmil
Ligand concentration regulates the pathways of coupled protein folding and binding
Descriptor: PYROPHOSPHATE, Ribonuclease P protein component
Authors:Tonthat, N.K.
Deposit date:2013-02-28
Release date:2014-01-22
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.296 Å)
Cite:Ligand concentration regulates the pathways of coupled protein folding and binding.
J.Am.Chem.Soc., 136, 2014
7WN8
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BU of 7wn8 by Molmil
Crystal structure of antibody (BC31M5) binds to CD47
Descriptor: BC31M5 Fab Heavy chain, BC31M5 Fab Light chain, Leukocyte surface antigen CD47, ...
Authors:Li, Y, Wang, W, Sui, J, Zhang, S.
Deposit date:2022-01-17
Release date:2023-01-25
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:A pH-dependent anti-CD47 antibody that selectively targets solid tumors and improves therapeutic efficacy and safety.
J Hematol Oncol, 16, 2023
7FFG
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BU of 7ffg by Molmil
Diarylpentanoid-producing polyketide synthase (N199F mutant)
Descriptor: Type III polyketide synthase
Authors:Morita, H, Wong, C.P, Liu, Q, Kodama, T, Lee, Y, Nakashima, Y.
Deposit date:2021-07-23
Release date:2022-01-19
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Identification of a diarylpentanoid-producing polyketide synthase revealing an unusual biosynthetic pathway of 2-(2-phenylethyl)chromones in agarwood.
Nat Commun, 13, 2022
6LLX
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BU of 6llx by Molmil
Discovery of A Dual Inhibitor of NQO1 and GSTP1 for Treating Malignant Glioblastoma
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLUTATHIONE, Glutathione S-transferase P
Authors:Ye, K, Li, H, Lei, K.C.
Deposit date:2019-12-24
Release date:2020-11-25
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.581 Å)
Cite:Discovery of a dual inhibitor of NQO1 and GSTP1 for treating glioblastoma.
J Hematol Oncol, 13, 2020
7FFH
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BU of 7ffh by Molmil
Diarylpentanoid-producing polyketide synthase (N199L mutant)
Descriptor: Type III polyketide synthase
Authors:Morita, H, Wong, C.P, Liu, Q, Takeshi, K, Lee, Y, Nakashima, Y.
Deposit date:2021-07-23
Release date:2022-01-19
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Identification of a diarylpentanoid-producing polyketide synthase revealing an unusual biosynthetic pathway of 2-(2-phenylethyl)chromones in agarwood.
Nat Commun, 13, 2022
7FFA
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BU of 7ffa by Molmil
Diarylpentanoid-producing polyketide synthase from Aquilaria sinensis
Descriptor: Type III polyketide synthase
Authors:Morita, H, Wong, C.P, Liu, Q, Kodama, T, Lee, Y, Nakashima, Y.
Deposit date:2021-07-23
Release date:2022-01-19
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Identification of a diarylpentanoid-producing polyketide synthase revealing an unusual biosynthetic pathway of 2-(2-phenylethyl)chromones in agarwood.
Nat Commun, 13, 2022
7FFC
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BU of 7ffc by Molmil
Diarylpentanoid-producing polyketide synthase (A210E mutant)
Descriptor: GLYCEROL, Type III polyketide synthase
Authors:Morita, H, Wong, C.P, Liu, Q, Kodama, T, Lee, Y, Nakashima, Y.
Deposit date:2021-07-23
Release date:2022-01-19
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.61 Å)
Cite:Identification of a diarylpentanoid-producing polyketide synthase revealing an unusual biosynthetic pathway of 2-(2-phenylethyl)chromones in agarwood.
Nat Commun, 13, 2022
7FFI
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BU of 7ffi by Molmil
Diarylpentanoid-producing polyketide synthase (F340W mutant)
Descriptor: Type III polyketide synthase
Authors:Morita, H, Wong, C.P, Liu, Q, Kodama, T, Lee, Y, Nakashima, Y.
Deposit date:2021-07-23
Release date:2022-01-19
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Identification of a diarylpentanoid-producing polyketide synthase revealing an unusual biosynthetic pathway of 2-(2-phenylethyl)chromones in agarwood.
Nat Commun, 13, 2022
4JPE
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BU of 4jpe by Molmil
Spirocyclic Beta-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitors
Descriptor: (4R)-2-amino-1,3',3'-trimethyl-7'-(pyrimidin-5-yl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-one, Beta-secretase 1, NICKEL (II) ION
Authors:Vigers, G.P.A, Smith, D.
Deposit date:2013-03-19
Release date:2013-04-10
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Spirocyclic beta-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors: from hit to lowering of cerebrospinal fluid (CSF) amyloid beta in a higher species.
J.Med.Chem., 56, 2013
4JPC
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BU of 4jpc by Molmil
Spirocyclic Beta-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitors
Descriptor: 3-[(4R)-2'-amino-1',2,2-trimethyl-5'-oxo-1',2,3,5'-tetrahydrospiro[chromene-4,4'-imidazol]-6-yl]benzonitrile, Beta-secretase 1, NICKEL (II) ION
Authors:Vigers, G.P.A, Smith, D.
Deposit date:2013-03-19
Release date:2013-04-10
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Spirocyclic beta-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors: from hit to lowering of cerebrospinal fluid (CSF) amyloid beta in a higher species.
J.Med.Chem., 56, 2013

227344

PDB entries from 2024-11-13

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