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7SEK
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BU of 7sek by Molmil
Solution structure of the zinc finger domain of murine MetAP1, complexed with ZNG N-terminal peptide
Descriptor: COBW domain-containing protein 1,Methionine aminopeptidase 1 fusion, ZINC ION
Authors:Edmonds, K.A, Jordan, M.R, Thalluri, K, Wu, H, Di Marchi, R, Giedroc, D.P.
Deposit date:2021-09-30
Release date:2022-06-01
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Zn-regulated GTPase metalloprotein activator 1 modulates vertebrate zinc homeostasis.
Cell, 185, 2022
8T98
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BU of 8t98 by Molmil
Diphosphoinositol polyphosphate phosphohydrolase 1 (DIPP1/NUDT3) in complex with Scyllo-3-PP-(1,2,4,5)IP4, Mg, and Fluoride ion
Descriptor: (1r,2R,3S,4r,5R,6S)-4-hydroxy-2,3,5,6-tetrakis(phosphonooxy)cyclohexyl trihydrogen diphosphate, CHLORIDE ION, Diphosphoinositol polyphosphate phosphohydrolase 1, ...
Authors:Zong, G, Wang, H, Shears, S.B.
Deposit date:2023-06-23
Release date:2023-11-15
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Biochemical and structural characterization of an inositol pyrophosphate kinase from a giant virus.
Embo J., 43, 2024
7V4Z
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BU of 7v4z by Molmil
Structure of Horcolin native form
Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
Authors:Bobbili, K.B, Sivaji, N, Jayaprakash, N.G, Narayanan, V, Sekhar, A, Suguna, K, Surolia, A.
Deposit date:2021-08-16
Release date:2022-03-09
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.16 Å)
Cite:Structure and Carbohydrate Recognition by the Nonmitogenic Lectin Horcolin.
Biochemistry, 61, 2022
8BT8
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BU of 8bt8 by Molmil
Notum Inhibitor ARUK3004048
Descriptor: 1,2-ETHANEDIOL, 1-indol-1-ylethanone, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Zhao, Y, Jones, E.Y, Fish, P.
Deposit date:2022-11-28
Release date:2022-12-28
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:Designed switch from covalent to non-covalent inhibitors of carboxylesterase Notum activity.
Eur.J.Med.Chem., 251, 2023
6XHL
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BU of 6xhl by Molmil
Covalent complex of SARS-CoV main protease with N-[(2S)-1-({(2S,3S)-3,4-dihydroxy-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide
Descriptor: 3C-like proteinase, N-[(2S)-1-({(2S,3S)-3,4-dihydroxy-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide
Authors:Gajiwala, K.S, Ferre, R.A, Ryan, K, Stewart, A.E.
Deposit date:2020-06-19
Release date:2020-07-08
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.471 Å)
Cite:Discovery of Ketone-Based Covalent Inhibitors of Coronavirus 3CL Proteases for the Potential Therapeutic Treatment of COVID-19.
J.Med.Chem., 63, 2020
7XEP
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BU of 7xep by Molmil
SufS with L-propargylglycine
Descriptor: 1,2-ETHANEDIOL, Cysteine desulfurase SufS, DI(HYDROXYETHYL)ETHER, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Inhibition mechanism of SufS by L-propargylglycine
to be published
8XOQ
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BU of 8xoq by Molmil
Human Calcium and Integrin Binding Protein 2 (CIB2) Fusion to TMC1 CBD-1 domain at 2.4 Angstroms resolution
Descriptor: MAGNESIUM ION, Transmembrane channel-like protein 1,Calcium and integrin-binding family member 2
Authors:Li, Y.H, Chen, J.S, Zhang, X, Wang, C.
Deposit date:2024-01-02
Release date:2025-01-15
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (2.41 Å)
Cite:Structural insights into calcium-dependent CIB2-TMC1 interaction in hair cell mechanotransduction.
Commun Biol, 8, 2025
7XEL
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BU of 7xel by Molmil
SufS soaked with D-penicillamine
Descriptor: 1,2-ETHANEDIOL, Cysteine desulfurase SufS, DI(HYDROXYETHYL)ETHER, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2025-04-02
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Visualizing thiazolidine ring formation in the reaction of D-cysteine and pyridoxal-5'-phosphate within L-cysteine desulfurase SufS.
Biochem.Biophys.Res.Commun., 754, 2025
5HX5
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BU of 5hx5 by Molmil
APOBEC3F Catalytic Domain Crystal Structure
Descriptor: DNA dC->dU-editing enzyme APOBEC-3F, ZINC ION
Authors:Shaban, N.M, Shi, K, Aihara, H, Harris, R.S.
Deposit date:2016-01-29
Release date:2016-05-18
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.33 Å)
Cite:1.92 Angstrom Zinc-Free APOBEC3F Catalytic Domain Crystal Structure.
J.Mol.Biol., 428, 2016
9BZ8
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BU of 9bz8 by Molmil
Pannexin 1 containing C-terminal activating domain
Descriptor: Pannexin
Authors:Ehrlich, J.J, Kawate, T.
Deposit date:2024-05-24
Release date:2024-12-04
Last modified:2024-12-25
Method:ELECTRON MICROSCOPY (3 Å)
Cite:The C-terminal activating domain promotes pannexin 1 channel opening.
Proc.Natl.Acad.Sci.USA, 121, 2024
5L8K
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BU of 5l8k by Molmil
Aurora-A kinase domain in complex with vNAR-D01 (crystal form 2)
Descriptor: 1,2-ETHANEDIOL, ADENOSINE-5'-DIPHOSPHATE, Aurora kinase A, ...
Authors:Burgess, S.G, Bayliss, R.
Deposit date:2016-06-08
Release date:2016-07-20
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Allosteric inhibition of Aurora-A kinase by a synthetic vNAR domain.
Open Biology, 6, 2016
8P7Y
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BU of 8p7y by Molmil
Mycoplasma pneumoniae 70S ribosome with second S4 protein on large subunit
Descriptor: 1,4-DIAMINOBUTANE, 16S ribosomal RNA, 23S ribosomal RNA, ...
Authors:Schacherl, M, Xue, L, Spahn, C.M.T, Mahamid, J.
Deposit date:2023-05-31
Release date:2024-11-20
Last modified:2025-03-12
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Structural insights into context-dependent inhibitory mechanisms of chloramphenicol in cells.
Nat.Struct.Mol.Biol., 32, 2025
8P8B
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BU of 8p8b by Molmil
Mycoplasma pneumoniae large ribosomal subunit in chloramphenicol-treated cells
Descriptor: 1,4-DIAMINOBUTANE, 16S ribosomal RNA, 23S ribosomal RNA, ...
Authors:Schacherl, M, Xue, L, Spahn, C.M.T, Mahamid, J.
Deposit date:2023-05-31
Release date:2024-11-20
Last modified:2025-03-12
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Structural insights into context-dependent inhibitory mechanisms of chloramphenicol in cells.
Nat.Struct.Mol.Biol., 32, 2025
8SR2
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BU of 8sr2 by Molmil
particulate methane monooxygenase incubated with 4,4,4-trifluorobutanol
Descriptor: 1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-dihexanoyl-sn-glycero-3-phosphocholine, Ammonia monooxygenase/methane monooxygenase, ...
Authors:Tucci, F.J, Rosenzweig, A.C.
Deposit date:2023-05-05
Release date:2023-11-15
Last modified:2025-03-05
Method:ELECTRON MICROSCOPY (2.36 Å)
Cite:Product analog binding identifies the copper active site of particulate methane monooxygenase.
Nat Catal, 6, 2023
7SRV
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BU of 7srv by Molmil
Metal dependent activation of Plasmodium falciparum M17 aminopeptidase (inactive form), spacegroup P22121
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, CALCIUM ION, ...
Authors:Webb, C.T, McGowan, S.
Deposit date:2021-11-08
Release date:2022-06-29
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:A metal ion-dependent conformational switch modulates activity of the Plasmodium M17 aminopeptidase.
J.Biol.Chem., 298, 2022
8P7X
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BU of 8p7x by Molmil
Mycoplasma pneumoniae 70S ribosome in chloramphenicol-treated cells
Descriptor: 1,4-DIAMINOBUTANE, 16S ribosomal RNA, 23S ribosomal RNA, ...
Authors:Schacherl, M, Xue, L, Spahn, C.M.T, Mahamid, J.
Deposit date:2023-05-31
Release date:2024-11-20
Last modified:2025-03-12
Method:ELECTRON MICROSCOPY (3.03 Å)
Cite:Structural insights into context-dependent inhibitory mechanisms of chloramphenicol in cells.
Nat.Struct.Mol.Biol., 32, 2025
7NHN
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BU of 7nhn by Molmil
VgaL, an antibiotic resistance ABCF, in complex with 70S ribosome from Listeria monocytogenes
Descriptor: 16S rRNA, 23S rRNA, 30S ribosomal protein S10, ...
Authors:Crowe-McAuliffe, C, Turnbull, K.J, Hauryliuk, V, Wilson, D.N.
Deposit date:2021-02-10
Release date:2021-05-05
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Structural basis of ABCF-mediated resistance to pleuromutilin, lincosamide, and streptogramin A antibiotics in Gram-positive pathogens.
Nat Commun, 12, 2021
6QY9
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BU of 6qy9 by Molmil
Human CSNK2A2 bound to a Pyrrolo[2,3-d]pyrimidinyl inhibitor
Descriptor: 1,2-ETHANEDIOL, 3-[3-[2-[(3,4,5-trimethoxyphenyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]phenyl]propanenitrile, CHLORIDE ION, ...
Authors:Abdul Azeez, K.R, Sorrell, F.J, Krojer, T, Bountra, C, Edwards, A.M, Arrowsmith, C, Knapp, S, Elkins, J.M.
Deposit date:2019-03-08
Release date:2019-04-17
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Human CSNK2A2 bound to a Pyrrolo[2,3-d]pyrimidinyl inhibitor
To Be Published
5HX4
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BU of 5hx4 by Molmil
Zinc-Free APOBEC3F Catalytic Domain Crystal Structure
Descriptor: DNA dC->dU-editing enzyme APOBEC-3F
Authors:Shaban, N.M, Shi, K, Aihara, H, Harris, R.S.
Deposit date:2016-01-29
Release date:2016-05-18
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:1.92 Angstrom Zinc-Free APOBEC3F Catalytic Domain Crystal Structure.
J.Mol.Biol., 428, 2016
7MSM
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BU of 7msm by Molmil
Mtb 70SIC in complex with MtbEttA at Trans_R0 state
Descriptor: 16S rRNA, 23S rRNA, 30S ribosomal protein S10, ...
Authors:Cui, Z, Zhang, J.
Deposit date:2021-05-11
Release date:2022-02-02
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (2.79 Å)
Cite:Interplay between an ATP-binding cassette F protein and the ribosome from Mycobacterium tuberculosis.
Nat Commun, 13, 2022
8J5L
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BU of 8j5l by Molmil
Structure of GH1 Br2 beta-glucosidase E163Q mutant from bovine rumen metagenome
Descriptor: Beta-glucosidase, GLYCEROL, SULFATE ION
Authors:Kaenying, W, Kongsaeree, P.T, Tagami, T.
Deposit date:2023-04-23
Release date:2023-11-22
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (2.095 Å)
Cite:Structural and mutational analysis of glycoside hydrolase family 1 Br2 beta-glucosidase derived from bovine rumen metagenome.
Heliyon, 9, 2023
8J3M
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BU of 8j3m by Molmil
Structure of GH1 Br2 beta-glucosidase from bovine rumen metagenome
Descriptor: Beta-glucosidase, GLYCEROL, SULFATE ION
Authors:Kaenying, W, Kongsaeree, P.T, Tagami, T.
Deposit date:2023-04-17
Release date:2023-11-22
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (1.999 Å)
Cite:Structural and mutational analysis of glycoside hydrolase family 1 Br2 beta-glucosidase derived from bovine rumen metagenome.
Heliyon, 9, 2023
7MSZ
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BU of 7msz by Molmil
Mtb 70SIC in complex with MtbEttA at Trans_R1 state
Descriptor: 16S rRNA, 23S rRNA, 30S ribosomal protein S10, ...
Authors:Cui, Z, Zhang, J.
Deposit date:2021-05-12
Release date:2022-02-02
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Interplay between an ATP-binding cassette F protein and the ribosome from Mycobacterium tuberculosis.
Nat Commun, 13, 2022
7MSH
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BU of 7msh by Molmil
Mtb 70SIC in complex with MtbEttA at Pre_R1 state
Descriptor: 16S rRNA, 23S rRNA, 30S ribosomal protein S10, ...
Authors:Cui, Z, Zhang, J.
Deposit date:2021-05-11
Release date:2022-02-02
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.23 Å)
Cite:Interplay between an ATP-binding cassette F protein and the ribosome from Mycobacterium tuberculosis.
Nat Commun, 13, 2022
9B5Y
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BU of 9b5y by Molmil
Cryo-EM structure of the LAPTH-bound PTH1R in complex with Gq
Descriptor: Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, Guanine nucleotide-binding protein G(q), ...
Authors:Zhang, X, Liu, H, Zhang, C, Vilardaga, J.-P.
Deposit date:2024-03-22
Release date:2025-03-19
Last modified:2025-06-04
Method:ELECTRON MICROSCOPY (3.49 Å)
Cite:Allosteric mechanism in the distinctive coupling of G q and G s to the parathyroid hormone type 1 receptor.
Proc.Natl.Acad.Sci.USA, 122, 2025

242842

數據於2025-10-08公開中

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