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6K80
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BU of 6k80 by Molmil
Crystal Structure of Drosophila melanogaster Dopamine N-Acetyltransferase in Complex with CoA and Tryptophol
Descriptor: 2-(1H-indol-3-yl)ethanol, ACETYL COENZYME *A, Dopamine N-acetyltransferase
Authors:Wu, C.Y, Hu, I.C, Yang, Y.C, Cheng, H.C, Lyu, P.C.
Deposit date:2019-06-11
Release date:2020-06-17
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:An essential role of acetyl coenzyme A in the catalytic cycle of insect arylalkylamine N-acetyltransferase.
Commun Biol, 3, 2020
7DBA
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BU of 7dba by Molmil
RYX in complex with tubulin
Descriptor: 2-(1-methylindol-4-yl)-7-(3,4,5-trimethoxyphenyl)-1~{H}-benzimidazole, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Wu, C.Y, Wang, Y.X.
Deposit date:2020-10-19
Release date:2021-10-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.461 Å)
Cite:RYX in complex with tubulin
To Be Published
7DBB
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BU of 7dbb by Molmil
SSE in complex with tubulin
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 5-phenyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide, CALCIUM ION, ...
Authors:Wu, C.Y, Wang, Y.X.
Deposit date:2020-10-19
Release date:2021-10-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.805 Å)
Cite:SSE in complex with tubulin
To Be Published
7DBC
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BU of 7dbc by Molmil
PRA in complex with tubulin
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Wu, C.Y, Wang, Y.X.
Deposit date:2020-10-19
Release date:2021-10-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:PRA in complex with tubulin
To Be Published
7DBD
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BU of 7dbd by Molmil
444 in complex with tubulin
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Wu, C.Y, Wang, Y.X.
Deposit date:2020-10-19
Release date:2021-10-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3.094 Å)
Cite:444 in complex with tubulin
To Be Published
7DB9
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BU of 7db9 by Molmil
IC1 in complex with tubulin
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 3-[(2,4,6-TRIMETHOXY-PHENYL)-METHYLENE]-INDOLIN-2-ONE, CALCIUM ION, ...
Authors:Wu, C.Y, Wang, Y.X.
Deposit date:2020-10-19
Release date:2021-10-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.845 Å)
Cite:IC1 in complex with tubulin
To Be Published
7XBI
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BU of 7xbi by Molmil
The crystal structure of human TrkA kinase bound to the inhibitor
Descriptor: 4-[[2-fluoranyl-5-(trifluoromethyl)phenyl]carbamoylamino]-~{N}-[3-(1-methylpyrazol-4-yl)-1~{H}-indazol-5-yl]-2-(trifluoromethyl)benzamide, CHLORIDE ION, High affinity nerve growth factor receptor
Authors:Wu, C.Y, Wang, G, Ouyang, L.
Deposit date:2022-03-21
Release date:2023-03-29
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:The crystal structure of human TrkA kinase bound to the inhibitor
To be published
1FSW
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BU of 1fsw by Molmil
AMPC BETA-LACTAMASE FROM E. COLI COMPLEXED WITH INHIBITOR CEPHALOTHINBORONIC ACID
Descriptor: CEPHALOSPORINASE, N-2-THIOPHEN-2-YL-ACETAMIDE BORONIC ACID, PHOSPHATE ION
Authors:Caselli, E, Powers, R.A, Blaszczak, L.C, Wu, C.Y, Prati, F, Shoichet, B.K.
Deposit date:2000-09-11
Release date:2001-03-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Energetic, structural, and antimicrobial analyses of beta-lactam side chain recognition by beta-lactamases.
Chem.Biol., 8, 2001
1FSY
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BU of 1fsy by Molmil
AMPC BETA-LACTAMASE FROM E. COLI COMPLEXED WITH INHIBITOR CLOXACILLINBORONIC ACID
Descriptor: CEPHALOSPORINASE, N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-4-CARBOXYLIC ACID AMIDE] BORONIC ACID, PHOSPHATE ION
Authors:Caselli, E, Powers, R.A, Blasczcak, L.C, Wu, C.Y, Prati, F, Shoichet, B.K.
Deposit date:2000-09-11
Release date:2001-03-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Energetic, structural, and antimicrobial analyses of beta-lactam side chain recognition by beta-lactamases.
Chem.Biol., 8, 2001
5J6A
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BU of 5j6a by Molmil
Crystal structure of pyruvate dehydrogenase kinase isoform 2 in complex with inhibitor PS46
Descriptor: (3S)-3-amino-4-[4-({2-[(2,4-dihydroxyphenyl)sulfonyl]-2H-isoindol-5-yl}amino)piperidin-1-yl]-4-oxobutanamide, [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial
Authors:Gui, W.J, Tso, S.C, Chuang, J.L, Wu, C.Y, Qi, X, Wynn, R.M, Chuang, D.T.
Deposit date:2016-04-04
Release date:2017-01-25
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.045 Å)
Cite:Development of Dihydroxyphenyl Sulfonylisoindoline Derivatives as Liver-Targeting Pyruvate Dehydrogenase Kinase Inhibitors.
J. Med. Chem., 60, 2017
5GIF
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BU of 5gif by Molmil
Crystal Structure of Drosophila melanogaster E47D Dopamine N-Acetyltransferase in Binary Complex with Acetyl-CoA
Descriptor: (4S,5S)-1,2-DITHIANE-4,5-DIOL, ACETYL COENZYME *A, Dopamine N-acetyltransferase
Authors:Yang, Y.C, Wu, C.Y, Cheng, H.C, Lyu, P.C.
Deposit date:2016-06-23
Release date:2017-07-05
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Crystal Structure of Drosophila melanogaster E47D Dopamine N-Acetyltransferase in Binary Complex with Acetyl-CoA
To Be Published
5GIG
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BU of 5gig by Molmil
Crystal Structure of Drosophila melanogaster E47D Dopamine N-Acetyltransferase in Ternary Complex with CoA and Acetyl-dopamine
Descriptor: (4S,5S)-1,2-DITHIANE-4,5-DIOL, COENZYME A, Dopamine N-acetyltransferase, ...
Authors:Yang, Y.C, Wu, C.Y, Cheng, H.C, Lyu, P.C.
Deposit date:2016-06-23
Release date:2017-07-05
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Crystal Structure of Drosophila melanogaster E47D Dopamine N-Acetyltransferase in Ternary Complex with CoA and Acetyl-dopamine
To Be Published
5GII
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BU of 5gii by Molmil
Crystal Structure of Drosophila melanogaster E47N Dopamine N-Acetyltransferase in Ternary Complex with CoA and Acetyl-phenylethylamine
Descriptor: COENZYME A, Dopamine N-acetyltransferase, N-(2-phenylethyl)acetamide
Authors:Yang, Y.C, Wu, C.Y, Cheng, H.C, Lyu, P.C.
Deposit date:2016-06-23
Release date:2017-07-05
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.294 Å)
Cite:Crystal Structure of Drosophila melanogaster E47N Dopamine N-Acetyltransferase in Ternary Complex with CoA and Acetyl-phenylethylamine
To Be Published
5J71
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BU of 5j71 by Molmil
Crystal structure of pyruvate dehydrogenase kinase isoform 2 in complex with inhibitor PS35
Descriptor: 4-({5-[(piperidin-4-yl)amino]-1,3-dihydro-2H-isoindol-2-yl}sulfonyl)benzene-1,3-diol, L(+)-TARTARIC ACID, [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, ...
Authors:Gui, W.J, Tso, S.C, Chuang, J.L, Wu, C.Y, Qi, X, Wynn, R.M, Chuang, D.T.
Deposit date:2016-04-05
Release date:2017-01-25
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Development of Dihydroxyphenyl Sulfonylisoindoline Derivatives as Liver-Targeting Pyruvate Dehydrogenase Kinase Inhibitors.
J. Med. Chem., 60, 2017
5GIH
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BU of 5gih by Molmil
Crystal Structure of Drosophila melanogaster E47D Dopamine N-Acetyltransferase in Ternary Complex with CoA and Acetyl-phenylethylamine
Descriptor: COENZYME A, Dopamine N-acetyltransferase, N-(2-phenylethyl)acetamide
Authors:Yang, Y.C, Wu, C.Y, Cheng, H.C, Lyu, P.C.
Deposit date:2016-06-23
Release date:2017-07-05
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.392 Å)
Cite:Crystal Structure of Drosophila melanogaster E47D Dopamine N-Acetyltransferase in Ternary Complex with CoA and Acetyl-phenylethylamine
To Be Published
8GUF
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BU of 8guf by Molmil
Crystal structure of cyclic B subunit of type II heat labile enterotoxin
Descriptor: Heat-labile enterotoxin IIB, B chain
Authors:Peng, Y.J, Wu, C.Y, Sue, S.C.
Deposit date:2022-09-12
Release date:2023-09-20
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Crystal structure of cyclic B subunit of type II heat labile enterotoxin
To Be Published
8HCG
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BU of 8hcg by Molmil
Crystal structure of mTREX1-dAMP complex
Descriptor: 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE, MAGNESIUM ION, PENTAETHYLENE GLYCOL, ...
Authors:Hsiao, Y.Y, Huang, K.W, Wu, C.Y.
Deposit date:2022-11-01
Release date:2023-11-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.799 Å)
Cite:Molecular insight into the specific enzymatic properties of TREX1 revealing the diverse functions in processing RNA and DNA/RNA hybrids.
Nucleic Acids Res., 51, 2023
8HCH
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BU of 8hch by Molmil
Crystal structure of mTREX1-Uridine complex
Descriptor: MAGNESIUM ION, Three-prime repair exonuclease 1, URIDINE
Authors:Hsiao, Y.Y, Huang, K.W, Wu, C.Y.
Deposit date:2022-11-01
Release date:2023-11-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Molecular insight into the specific enzymatic properties of TREX1 revealing the diverse functions in processing RNA and DNA/RNA hybrids.
Nucleic Acids Res., 51, 2023
8HCD
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BU of 8hcd by Molmil
Crystal structure of mTREX1-DNA product complex (dNMP)
Descriptor: 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE, 2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE, COBALT (II) ION, ...
Authors:Hsiao, Y.Y, Huang, K.W, Wu, C.Y.
Deposit date:2022-11-01
Release date:2023-11-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Molecular insight into the specific enzymatic properties of TREX1 revealing the diverse functions in processing RNA and DNA/RNA hybrids.
Nucleic Acids Res., 51, 2023
8HCF
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BU of 8hcf by Molmil
Crystal structure of mTREX1-UMP complex
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, SULFATE ION, Three-prime repair exonuclease 1, ...
Authors:Hsiao, Y.Y, Huang, K.W, Wu, C.Y.
Deposit date:2022-11-01
Release date:2023-11-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Molecular insight into the specific enzymatic properties of TREX1 revealing the diverse functions in processing RNA and DNA/RNA hybrids.
Nucleic Acids Res., 51, 2023
8HCC
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BU of 8hcc by Molmil
Crystal structure of mTREX1-RNA product complex (AMP)
Descriptor: ADENOSINE MONOPHOSPHATE, MAGNESIUM ION, SODIUM ION, ...
Authors:Hsiao, Y.Y, Huang, K.W, Wu, C.Y.
Deposit date:2022-11-01
Release date:2023-11-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Molecular insight into the specific enzymatic properties of TREX1 revealing the diverse functions in processing RNA and DNA/RNA hybrids.
Nucleic Acids Res., 51, 2023
8HCE
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BU of 8hce by Molmil
Crystal structure of mTREX1-CMP complex
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, AMMONIUM ION, CYTIDINE-5'-MONOPHOSPHATE, ...
Authors:Hsiao, Y.Y, Huang, K.W, Wu, C.Y.
Deposit date:2022-11-01
Release date:2023-11-08
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.501 Å)
Cite:Molecular insight into the specific enzymatic properties of TREX1 revealing the diverse functions in processing RNA and DNA/RNA hybrids.
Nucleic Acids Res., 51, 2023
8HY7
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BU of 8hy7 by Molmil
EGFR kinase domain mutant "TMLR" with compound 28f
Descriptor: Epidermal growth factor receptor, ~{N}-[3-[[6-fluoranyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinazolin-4-yl]amino]phenyl]prop-2-enamide
Authors:Wang, Y.X, Wu, C.Y.
Deposit date:2023-01-06
Release date:2023-08-23
Method:X-RAY DIFFRACTION (2.91 Å)
Cite:The crystal structure of EGFR kinase domain(T790M/L858R) in complex with compound 28f
To Be Published
8I0B
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BU of 8i0b by Molmil
The crystal structure of human glutamate receptor 2 in complex with LT-102
Descriptor: 8-[4-(2-fluorophenyl)phenyl]-3,4-dihydro-1,2$l^{6},3-benzoxathiazine 2,2-dioxide, CHLORIDE ION, Glutamate receptor 2,Isoform Flip of Glutamate receptor 2, ...
Authors:Qi, X.Y, Wu, C.Y.
Deposit date:2023-01-10
Release date:2024-02-07
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Structure of the human GluA2 LBD in complex with LT-102
To Be Published
7CEM
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BU of 7cem by Molmil
Crystal Structure of YbeA CP74 W7F
Descriptor: Ribosomal RNA large subunit methyltransferase H,Ribosomal RNA large subunit methyltransferase H
Authors:Liu, C.Y, Wu, C.Y, Lai, C.H, Hsu, S.T.D, Lyu, P.C.
Deposit date:2020-06-23
Release date:2021-06-23
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.4251 Å)
Cite:Crystal Structure of YbeA CP74 W7F
To Be Published

 

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