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8JJY
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BU of 8jjy by Molmil
Crystal structure of QN-hNTAQ1 C28S
Descriptor: Protein N-terminal glutamine amidohydrolase
Authors:Kang, J.M, Han, B.W.
Deposit date:2023-05-31
Release date:2024-06-26
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Structural study for substrate recognition of human N-terminal glutamine amidohydrolase 1 in the arginine N-degron pathway.
Protein Sci., 33, 2024
8EDY
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BU of 8edy by Molmil
KRAS4b A146T 1-185 bound to GDP
Descriptor: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE
Authors:Betts, L, Rossman, K.L.
Deposit date:2022-09-06
Release date:2023-09-20
Method:X-RAY DIFFRACTION (1.18 Å)
Cite:KRAS4b A146T 1-185 bound to GDP
To Be Published
8JJW
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BU of 8jjw by Molmil
Crystal structure of QG-hNTAQ1 C28S
Descriptor: MAGNESIUM ION, Protein N-terminal glutamine amidohydrolase
Authors:Kang, J.M, Han, B.W.
Deposit date:2023-05-31
Release date:2024-06-26
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Structural study for substrate recognition of human N-terminal glutamine amidohydrolase 1 in the arginine N-degron pathway.
Protein Sci., 33, 2024
8JJZ
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BU of 8jjz by Molmil
Crystal structure of QQ-hNTAQ1 C28S
Descriptor: Protein N-terminal glutamine amidohydrolase
Authors:Kang, J.M, Han, B.W.
Deposit date:2023-05-31
Release date:2024-06-26
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Structural study for substrate recognition of human N-terminal glutamine amidohydrolase 1 in the arginine N-degron pathway.
Protein Sci., 33, 2024
8G9Z
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BU of 8g9z by Molmil
High-resolution crystal structure of the human selenomethionine-derived SepSecS-tRNASec complex
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (5-HYDROXY-4,6-DIMETHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE, O-phosphoseryl-tRNA(Sec) selenium transferase, ...
Authors:Puppala, A, Simonovic, M, Castillo Suchkou, J.
Deposit date:2023-02-22
Release date:2023-04-05
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Structural basis for the tRNA-dependent activation of the terminal complex of selenocysteine synthesis in humans.
Nucleic Acids Res., 51, 2023
8JJX
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BU of 8jjx by Molmil
Crystal structure of QS-hNTAQ1 C28S
Descriptor: Protein N-terminal glutamine amidohydrolase
Authors:Kang, J.M, Han, B.W.
Deposit date:2023-05-31
Release date:2024-06-26
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural study for substrate recognition of human N-terminal glutamine amidohydrolase 1 in the arginine N-degron pathway.
Protein Sci., 33, 2024
7SUJ
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BU of 7suj by Molmil
Structure of CHK1 10-pt. mutant complex with LRRK2 inhibitor 24
Descriptor: (3R,4R)-4-{4-[6-chloro-2-({1-[(1R)-2,2-difluorocyclopropyl]-5-methyl-1H-pyrazol-4-yl}amino)quinazolin-7-yl]piperidin-1-yl}-4-methyloxolan-3-ol, Serine/threonine-protein kinase Chk1
Authors:Palte, R.L.
Deposit date:2021-11-17
Release date:2022-01-12
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.299 Å)
Cite:Structure-Guided Discovery of Aminoquinazolines as Brain-Penetrant and Selective LRRK2 Inhibitors.
J.Med.Chem., 65, 2022
6NJA
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BU of 6nja by Molmil
Structure of WT RET protein tyrosine kinase domain at 1.92A resolution.
Descriptor: ADENINE, FORMIC ACID, Proto-oncogene tyrosine-protein kinase receptor Ret
Authors:Terzyan, S.S, Shen, T, Wu, J, Mooers, B.H.M.
Deposit date:2019-01-02
Release date:2019-06-05
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:Structural basis of resistance of mutant RET protein-tyrosine kinase to its inhibitors nintedanib and vandetanib.
J.Biol.Chem., 294, 2019
7BZL
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BU of 7bzl by Molmil
GH127 beta-L-arabinofuranosidase HypBA1 covalently complexed with beta-L-arabinofuranose-configured cyclophellitol
Descriptor: (1S,2S,3R,4R)-3-(hydroxymethyl)cyclopentane-1,2,4-triol, Non-reducing end beta-L-arabinofuranosidase, ZINC ION
Authors:Amaki, S, McGregor, N.G.S, Arakawa, T, Yamada, C, Borlandelli, V, Overkleeft, H.S, Davies, G.J, Fushinobu, S.
Deposit date:2020-04-28
Release date:2021-01-27
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Cysteine Nucleophiles in Glycosidase Catalysis: Application of a Covalent beta-l-Arabinofuranosidase Inhibitor.
Angew.Chem.Int.Ed.Engl., 60, 2021
7TE8
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BU of 7te8 by Molmil
CA14-CBD-DB21 ternary complex
Descriptor: CA14, DB21, cannabidiol
Authors:Cao, S, Zheng, N.
Deposit date:2022-01-04
Release date:2022-01-12
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.998 Å)
Cite:Defining molecular glues with a dual-nanobody cannabidiol sensor.
Nat Commun, 13, 2022
8J4V
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BU of 8j4v by Molmil
Structure of Mycobacterium thermoresistibile NrdI(oxidised) determined at 1.1 angstrom resolution
Descriptor: FLAVIN MONONUCLEOTIDE, GLYCEROL, PHOSPHATE ION, ...
Authors:Yadav, L.R, Mande, S.C.
Deposit date:2023-04-21
Release date:2024-10-09
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.11 Å)
Cite:Structural insights into the initiation of free radical formation in the Class Ib ribonucleotide reductases in Mycobacteria.
Curr Res Struct Biol, 8, 2024
9KCT
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BU of 9kct by Molmil
Crystal structure of Tagatose 4-epimerase from Thermoprotei archaeon
Descriptor: 1,2-ETHANEDIOL, 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL, DI(HYDROXYETHYL)ETHER, ...
Authors:Chen, J, Luo, G, Huang, Z, Ni, D, Zhu, Y, Xu, W, Zhang, W, Mu, W.
Deposit date:2024-11-02
Release date:2025-11-05
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Crystal structure of Tagatose 4-epimerase from Thermoprotei archaeon
To Be Published
8XGJ
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BU of 8xgj by Molmil
Human Cx36/GJD2 gap junction channel in complex with mefloquine.
Descriptor: (11R,12S)- Mefloquine, 1,2-DIMYRISTOYL-RAC-GLYCERO-3-PHOSPHOCHOLINE, Gap junction delta-2 protein
Authors:Cho, H.J, Lee, H.H.
Deposit date:2023-12-15
Release date:2024-11-06
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Mefloquine-induced conformational shift in Cx36 N-terminal helix leading to channel closure mediated by lipid bilayer.
Nat Commun, 15, 2024
6NQW
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BU of 6nqw by Molmil
Flagellar protein FcpA from Leptospira biflexa - hexagonal form
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Flagellar coiling protein A, GLYCEROL, ...
Authors:San Martin, F, Trajtenberg, F, Larrieux, N, Buschiazzo, A.
Deposit date:2019-01-22
Release date:2020-01-29
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:An asymmetric sheath controls flagellar supercoiling and motility in the Leptospira spirochete
Elife, 9, 2020
6CUQ
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BU of 6cuq by Molmil
Crystal structure of Macrophage migration inhibitory factor-like protein (EhMIF) from Entamoeba histolytica
Descriptor: 1,2-ETHANEDIOL, Macrophage migration inhibitory factor-like protein
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2018-03-26
Release date:2018-04-11
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Crystal structure of Macrophage migration inhibitory factor-like protein (EhMIF) from Entamoeba histolytica
to be published
8JAG
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BU of 8jag by Molmil
Cryo-EM structure of SARS-CoV-1 RBD in complex with W328-6H2 (local refinement)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, H chain of 6H2 Fab region, L chain of 6H2 Fab region, ...
Authors:Nan, X.Y, Li, Y.J.
Deposit date:2023-05-06
Release date:2024-12-18
Method:ELECTRON MICROSCOPY (3.55 Å)
Cite:Cryo-EM structure of SARS-CoV-1 2p RBD in complex with W328-6H2 ( local refinement)
To Be Published
8OUV
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BU of 8ouv by Molmil
Crystal structure of D1228V c-MET bound by compound 15
Descriptor: 5-(1H-indazol-7-yl)-1-[(1S)-1-phenylethyl]pyrimidine-2,4-dione, CHLORIDE ION, Hepatocyte growth factor receptor
Authors:Collie, G.W.
Deposit date:2023-04-24
Release date:2023-07-05
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (1.783 Å)
Cite:Discovery and Optimization of the First ATP Competitive Type-III c-MET Inhibitor.
J.Med.Chem., 66, 2023
7PLQ
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BU of 7plq by Molmil
Crystal structure of the PARP domain of wheat SRO1
Descriptor: 1,2-ETHANEDIOL, 1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE, GLYCEROL, ...
Authors:Wirthmueller, L, Loll, B.
Deposit date:2021-09-01
Release date:2021-10-27
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:The superior salinity tolerance of bread wheat cultivar Shanrong No. 3 is unlikely to be caused by elevated Ta-sro1 poly-(ADP-ribose) polymerase activity.
Plant Cell, 34, 2022
8ZTO
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BU of 8zto by Molmil
Cryo-EM structure of the human XPR1
Descriptor: PHOSPHATE ION, Solute carrier family 53 member 1, [(2~{R})-1-hexadecanoyloxy-3-[oxidanyl-[2-(trimethyl-$l^{4}-azanyl)ethoxy]phosphoryl]oxy-propan-2-yl] octadec-9-enoate
Authors:She, J, Chen, L.
Deposit date:2024-06-07
Release date:2025-04-09
Last modified:2025-07-23
Method:ELECTRON MICROSCOPY (3.55 Å)
Cite:Structure and function of human XPR1 in phosphate export.
Nat Commun, 16, 2025
5H80
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BU of 5h80 by Molmil
Biotin Carboxylase domain of single-chain bacterial carboxylase
Descriptor: 1,2-ETHANEDIOL, Carboxylase
Authors:Hagmann, A, Hunkeler, M, Stuttfeld, E, Maier, T.
Deposit date:2015-12-23
Release date:2016-07-20
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Hybrid Structure of a Dynamic Single-Chain Carboxylase from Deinococcus radiodurans.
Structure, 24, 2016
8T3X
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BU of 8t3x by Molmil
TNA polymerase, closed ternary
Descriptor: 10-92, TNA polymerase, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ...
Authors:Maola, V, Chaput, J, Chim, N.
Deposit date:2023-06-07
Release date:2024-08-28
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.73 Å)
Cite:Directed evolution of a highly efficient TNA polymerase achieved by homologous recombination
Nat Catal, 2024
6R0U
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BU of 6r0u by Molmil
Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 5a and hydrolysis product
Descriptor: 3-azanyl-2-[[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]carbamoyl]benzoic acid, 4-azanyl-2-[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]isoindole-1,3-dione, CHLORIDE ION, ...
Authors:Heim, C, Hartmann, M.D.
Deposit date:2019-03-13
Release date:2019-08-07
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives.
J.Med.Chem., 62, 2019
6R0S
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BU of 6r0s by Molmil
Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 4a and hydrolysis product
Descriptor: 2-[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-4-nitro-isoindole-1,3-dione, 2-[[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]carbamoyl]-6-nitro-benzoic acid, CEREBLON ISOFORM 4, ...
Authors:Heim, C, Hartmann, M.D.
Deposit date:2019-03-13
Release date:2019-08-07
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives.
J.Med.Chem., 62, 2019
5HBB
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BU of 5hbb by Molmil
Crystal structure of shaft pilin spaA from Lactobacillus rhamnosus GG - E139A mutant
Descriptor: 1,2-ETHANEDIOL, Cell surface protein SpaA, SODIUM ION, ...
Authors:Chaurasia, P, Pratap, S, von Ossowski, I, Palva, A, Krishnan, V.
Deposit date:2015-12-31
Release date:2016-07-20
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.47 Å)
Cite:New insights about pilus formation in gut-adapted Lactobacillus rhamnosus GG from the crystal structure of the SpaA backbone-pilin subunit
Sci Rep, 6, 2016
6R11
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BU of 6r11 by Molmil
Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 5b
Descriptor: 5-azanyl-2-[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]isoindole-1,3-dione, CHLORIDE ION, Cereblon isoform 4, ...
Authors:Heim, C, Hartmann, M.D.
Deposit date:2019-03-13
Release date:2019-08-07
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives.
J.Med.Chem., 62, 2019

244693

数据于2025-11-12公开中

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