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PDB: 21671 results

6KZE
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BU of 6kze by Molmil
The crystal structue of PDE10A complexed with 4d
Descriptor: 8-[(E)-2-[5-methyl-1-[3-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]benzimidazol-2-yl]ethenyl]quinoline, MAGNESIUM ION, ZINC ION, ...
Authors:Yang, Y, Zhang, S, Zhou, Q, Huang, Y.-Y, Guo, L, Luo, H.-B.
Deposit date:2019-09-24
Release date:2020-09-30
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.50003481 Å)
Cite:Novel Potent and Highly Selective Benzoimidazole-based Phosphodiesterase 10 Inhibitors with Improved Solubility and Pharmacokinetic Properties for the Treatment of Pulmonary Arterial Hypertension
To Be Published
5FTQ
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BU of 5ftq by Molmil
Crystal structure of the ALK kinase domain in complex with Cmpd 17
Descriptor: ALK TYROSINE KINASE RECEPTOR, GLYCEROL, N-[5-(3,5-DIFLUOROBENZYL)-1H-INDAZOL-3-YL]-2-[(4-HYDROXYCYCLOHEXYL)AMINO]-4-(4-METHYLPIPERAZIN-1-YL) BENZAMIDE
Authors:Bossi, R, Canevari, G, Fasolini, M, Menichincheri, M, Ardini, E, Magnaghi, P, Avanzi, N, Banfi, P, Buffa, L, Ceriani, L, Colombo, M, Corti, L, Donati, D, Felder, E, Fiorelli, C, Fiorentini, F, Galvani, A, Isacchi, A, Lombardi Borgia, A, Marchionni, C, Nesi, M, Orrenius, C, Panzeri, A, Perrone, E, Pesenti, E, Rusconi, L, Saccardo, M.B, Vanotti, E, Orsini, P.
Deposit date:2016-01-14
Release date:2016-04-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Discovery of Entrectinib: A New 3-Aminoindazole as a Potent Anaplastic Lymphoma Kinase (Alk), C-Ros Oncogene 1 Kinase (Ros1), and Pan-Tropomyosin Receptor Kinases (Pan-Trks) Inhibitor.
J.Med.Chem., 59, 2016
6L0Z
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BU of 6l0z by Molmil
The crystal structure of Salmonella enterica sugar-binding protein MalE
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 1,5-anhydro-D-glucitol, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ...
Authors:Wang, L, Chen, Y, Liu, W, Lan, J, Shang, F, Xu, Y.
Deposit date:2019-09-27
Release date:2019-10-16
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The crystal structure of Salmonella enterica sugar-binding protein MalE
To Be Published
6L2Z
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BU of 6l2z by Molmil
IlvC, a ketol-acid reductoisomerase, from Streptococcus pnuemoniae_D191G
Descriptor: AMMONIUM ION, GLYCEROL, Ketol-acid reductoisomerase (NADP(+)), ...
Authors:Gyuhee, K, Donghyuk, S, Sumin, L, Jaesook, Y, Sangho, L.
Deposit date:2019-10-07
Release date:2020-08-12
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:Crystal Structure of IlvC, a Ketol-Acid Reductoisomerase, from Streptococcus Pneumoniae.
Crystals, 9, 2019
6L48
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BU of 6l48 by Molmil
Structure of the human sterol O-acyltransferase 1 in resting state
Descriptor: CHOLESTEROL, Sterol O-acyltransferase 1
Authors:Chen, L, Guan, C, Niu, Y.
Deposit date:2019-10-16
Release date:2020-04-29
Last modified:2024-03-27
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Structural insights into the inhibition mechanism of human sterol O-acyltransferase 1 by a competitive inhibitor.
Nat Commun, 11, 2020
6LCP
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BU of 6lcp by Molmil
Cryo-EM structure of Dnf1 from Chaetomium thermophilum in the E2P state
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:He, Y, Xu, J, Wu, X, Li, L.
Deposit date:2019-11-19
Release date:2020-04-29
Last modified:2020-07-29
Method:ELECTRON MICROSCOPY (3.48 Å)
Cite:Structures of a P4-ATPase lipid flippase in lipid bilayers.
Protein Cell, 11, 2020
6L9L
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BU of 6l9l by Molmil
1D4 TCR recognition of H2-Ld a1a2 A5 Peptide Complexes
Descriptor: H2-Ld a1a2, SER-PRO-SER-TYR-ALA-TYR-HIS-GLN-PHE, T Cell Receptor
Authors:Wei, P.C, Yin, L.
Deposit date:2019-11-10
Release date:2020-11-18
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.399 Å)
Cite:Structures suggest an approach for converting weak self-peptide tumor antigens into superagonists for CD8 T cells in cancer.
Proc.Natl.Acad.Sci.USA, 118, 2021
6L2I
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BU of 6l2i by Molmil
IlvC, a ketol-acid reductoisomerase, from Streptococcus pneumoniae_WT
Descriptor: GLYCEROL, Ketol-acid reductoisomerase (NADP(+)), MAGNESIUM ION, ...
Authors:Gyuhee, K, Donghyuk, S, Sumin, L, Jaesook, Y, Sangho, L.
Deposit date:2019-10-04
Release date:2020-08-12
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Crystal Structure of IlvC, a Ketol-Acid Reductoisomerase, from Streptococcus Pneumoniae.
Crystals, 9, 2019
6L47
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BU of 6l47 by Molmil
Structure of the human sterol O-acyltransferase 1 in complex with CI-976
Descriptor: 2,2-dimethyl-N-(2,4,6-trimethoxyphenyl)dodecanamide, CHOLESTEROL, Sterol O-acyltransferase 1
Authors:Chen, L, Guan, C, Niu, Y.
Deposit date:2019-10-16
Release date:2020-04-29
Last modified:2020-10-07
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Structural insights into the inhibition mechanism of human sterol O-acyltransferase 1 by a competitive inhibitor.
Nat Commun, 11, 2020
6L19
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BU of 6l19 by Molmil
The crystal structure of competence or damage-inducible protein from Enterobacter asburiae
Descriptor: CHLORIDE ION, GLYCEROL, PncC family amidohydrolase, ...
Authors:Wang, L, Chen, Y, Liu, W, Lan, J, Shang, F, Xu, Y.
Deposit date:2019-09-28
Release date:2019-10-16
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:The crystal structure of Competence or damage-inducible protein from Enterobacter asburiae
To Be Published
6L9M
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BU of 6l9m by Molmil
H2-Ld complexed with AH1 peptide
Descriptor: H2-Ld, SER-PRO-SER-TYR-VAL-TYR-HIS-GLN-PHE, b2m
Authors:Wei, P.C, Yin, L.
Deposit date:2019-11-10
Release date:2020-11-18
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structures suggest an approach for converting weak self-peptide tumor antigens into superagonists for CD8 T cells in cancer.
Proc.Natl.Acad.Sci.USA, 118, 2021
6LAN
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BU of 6lan by Molmil
Structure of CCDC50 and LC3B complex
Descriptor: Coiled-coil domain-containing protein 50,Microtubule-associated proteins 1A/1B light chain 3B
Authors:Liu, L, Li, J, Hou, P.
Deposit date:2019-11-12
Release date:2020-09-30
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.41 Å)
Cite:A novel selective autophagy receptor, CCDC50, delivers K63 polyubiquitination-activated RIG-I/MDA5 for degradation during viral infection.
Cell Res., 31, 2021
6LBA
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BU of 6lba by Molmil
Cryo-EM structure of the AtMLKL2 tetramer
Descriptor: Protein kinase family protein
Authors:Lisa, M, Huang, M, Zhang, X, Ryohei, T.N, Leila, B.K, Isabel, M.L.S, Florence, J, Viera, K, Dmitry, L, Jane, E.P, James, M.M, Kay, H, Paul, S.L, Chai, J, Takaki, M.
Deposit date:2019-11-13
Release date:2020-11-18
Last modified:2024-03-27
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:Cryo-EM structure of the AtMLKL3 tetramer
To Be Published
6LGM
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BU of 6lgm by Molmil
Crystal structure of an oxido-reductase with mutation and inhibitor
Descriptor: Dimethyl fumarate, Glyceraldehyde-3-phosphate dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
Authors:Yang, Y, Lei, J, Yin, L.
Deposit date:2019-12-05
Release date:2020-12-09
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal structure of an oxido-reductase with mutation and inhibitor
To Be Published
6L0U
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BU of 6l0u by Molmil
Crystal structure of mouse glyoxalase I complexed with a small molecule inhibitor
Descriptor: Lactoylglutathione lyase, N-[4-(trifluoromethyloxy)phenyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide, ZINC ION
Authors:Jiang, L.L, Zhou, L.
Deposit date:2019-09-27
Release date:2020-09-30
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal structure of mouse glyoxalase I complexed with a small molecule inhibitor
To Be Published
6L4R
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BU of 6l4r by Molmil
Crystal structure of Enterovirus D68 RdRp
Descriptor: RdRp
Authors:Wang, M.L, Li, L, Zhang, Y, Chen, Y.P, Su, D.
Deposit date:2019-10-21
Release date:2020-06-10
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.147 Å)
Cite:Structure of the enterovirus D68 RNA-dependent RNA polymerase in complex with NADPH implicates an inhibitor binding site in the RNA template tunnel.
J.Struct.Biol., 211, 2020
6L2S
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BU of 6l2s by Molmil
IlvC, a ketol-acid reductoisomerase, from Streptococcus pneumoniae_D83G
Descriptor: Ketol-acid reductoisomerase (NADP(+))
Authors:Gyuhee, K, Donghyuk, S, Sumin, L, Jaesook, Y, Sangho, L.
Deposit date:2019-10-06
Release date:2020-08-12
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Crystal Structure of IlvC, a Ketol-Acid Reductoisomerase, from Streptococcus Pneumoniae.
Crystals, 9, 2019
6L74
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BU of 6l74 by Molmil
Thermus thermophilus initial transcription complex comprising sigma A and 5'-triphosphate RNA of 2 nt
Descriptor: DNA (5'-D(*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*CP*GP*AP*G)-3'), DNA (5'-D(*TP*AP*TP*AP*AP*TP*GP*GP*GP*AP*GP*CP*TP*GP*TP*CP*AP*CP*GP*GP*AP*TP*GP*C)-3'), DNA-directed RNA polymerase subunit alpha, ...
Authors:Zhang, Y, Li, L, Ebright, R.H.
Deposit date:2019-10-31
Release date:2020-03-11
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.12 Å)
Cite:RNA extension drives a stepwise displacement of an initiation-factor structural module in initial transcription.
Proc.Natl.Acad.Sci.USA, 117, 2020
6L8J
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BU of 6l8j by Molmil
Crystal structure of CYP97A3 mutant S290D/W300L/S304V in complex with retinal
Descriptor: PROTOPORPHYRIN IX CONTAINING FE, Protein LUTEIN DEFICIENT 5, chloroplastic, ...
Authors:Niu, G, Guo, Q, Liu, L.
Deposit date:2019-11-06
Release date:2020-06-10
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.399 Å)
Cite:Structural basis for plant lutein biosynthesis from alpha-carotene.
Proc.Natl.Acad.Sci.USA, 117, 2020
6LCR
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BU of 6lcr by Molmil
Cryo-EM structure of Dnf1 from Chaetomium thermophilum in the E1-ATP state
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Cdc50, ...
Authors:He, Y, Xu, J, Wu, X, Li, L.
Deposit date:2019-11-19
Release date:2020-04-29
Last modified:2020-07-29
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Structures of a P4-ATPase lipid flippase in lipid bilayers.
Protein Cell, 11, 2020
6LCU
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BU of 6lcu by Molmil
structure of maltooligosyltrehalose synthase from Arthrobacter ramosus
Descriptor: MTSase
Authors:Chen, C, Su, L, Wu, L, Zhou, J, Wu, J.
Deposit date:2019-11-20
Release date:2020-11-25
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:structure of maltooligosyltrehalose synthase from Arthrobacter ramosus
To Be Published
6KZ1
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Complex structure of Whirlin and Myosin XVa
Descriptor: Myosin XVa, Whirlin
Authors:Lin, L, Wang, M, Shi, Y, Zhu, J, Zhang, R.
Deposit date:2019-09-22
Release date:2020-09-23
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.694 Å)
Cite:Phase separation-mediated condensation of Whirlin-Myo15-Eps8 stereocilia tip complex.
Cell Rep, 34, 2021
6KZ6
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BU of 6kz6 by Molmil
Crystal structure of ASFV dUTPase
Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, E165R, MAGNESIUM ION
Authors:Guo, Y, Chen, C, Li, G.B, Cao, L, Wang, C.W.
Deposit date:2019-09-23
Release date:2019-11-13
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.187 Å)
Cite:Structural Insight into African Swine Fever Virus dUTPase Reveals a Novel Folding Pattern in the dUTPase Family.
J.Virol., 94, 2020
8FNZ
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BU of 8fnz by Molmil
Acetylated tau repeat 1 and 2 fragment (AcR1R2)
Descriptor: Microtubule-associated protein tau, acetylated repeat 1 and 2 fragment
Authors:Li, L, Nguyen, A.B, Mullapudi, V, Joachimiak, L.
Deposit date:2022-12-29
Release date:2023-06-28
Last modified:2023-11-15
Method:ELECTRON MICROSCOPY (3.88 Å)
Cite:Disease-associated patterns of acetylation stabilize tau fibril formation.
Structure, 31, 2023
8FG2
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SARS-CoV-2 Nucleocapsid dimer structure determined from COVID-19 patients
Descriptor: Nucleoprotein
Authors:Casasanta, M, Jonaid, G.M, Kaylor, L, Luqiu, W, DiCecco, L, Solares, M, Berry, S, Kelly, D.F.
Deposit date:2022-12-12
Release date:2023-01-11
Last modified:2023-10-11
Method:ELECTRON MICROSCOPY (6 Å)
Cite:Structural Insights of the SARS-CoV-2 Nucleocapsid Protein: Implications for the Inner-workings of Rapid Antigen Tests.
Microsc Microanal, 29, 2023

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PDB entries from 2024-10-09

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