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4YH4
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BU of 4yh4 by Molmil
Crystal structure of human BRD4(1) in complex with 4-[(5-phenylpyridin-3-yl)carbonyl]-3,4-dihydroquinoxalin-2(1H)-one (compound 19d)
Descriptor: 4-[(5-phenylpyridin-3-yl)carbonyl]-3,4-dihydroquinoxalin-2(1H)-one, Bromodomain-containing protein 4, GLYCEROL, ...
Authors:Lakshminarasimhan, D, White, A, Suto, R.K.
Deposit date:2015-02-26
Release date:2016-01-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.33 Å)
Cite:Discovery of a new chemical series of BRD4(1) inhibitors using protein-ligand docking and structure-guided design.
Bioorg.Med.Chem.Lett., 25, 2015
5XV8
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BU of 5xv8 by Molmil
Solution structure of the complex between UVSSA acidic region and TFIIH p62 PH domain
Descriptor: General transcription factor IIH subunit 1, UV-stimulated scaffold protein A
Authors:Okuda, M, Nishimura, Y.
Deposit date:2017-06-27
Release date:2017-11-08
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Common TFIIH recruitment mechanism in global genome and transcription-coupled repair subpathways
Nucleic Acids Res., 45, 2017
4NNI
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BU of 4nni by Molmil
Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide
Descriptor: 30S ribosomal protein S1, PYRAZINE-2-CARBOXYLIC ACID
Authors:Yang, J, Liu, Y, Cai, Q, Lin, D.
Deposit date:2013-11-18
Release date:2014-12-24
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.64 Å)
Cite:Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide.
Mol.Microbiol., 95, 2015
4NNH
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BU of 4nnh by Molmil
Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide
Descriptor: 30S ribosomal protein S1
Authors:Yang, J, Liu, Y, Cai, Q, Lin, D.
Deposit date:2013-11-18
Release date:2014-12-24
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide.
Mol.Microbiol., 95, 2015
4NNG
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BU of 4nng by Molmil
Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide
Descriptor: 30S ribosomal protein S1
Authors:Yang, J, Liu, Y, Cai, Q, Lin, D.
Deposit date:2013-11-18
Release date:2014-12-24
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide.
Mol.Microbiol., 95, 2015
4NNK
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BU of 4nnk by Molmil
Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide
Descriptor: 30S ribosomal protein S1
Authors:Yang, J, Liu, Y, Cai, Q, Lin, D.
Deposit date:2013-11-18
Release date:2014-12-24
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Structural basis for targeting the ribosomal protein S1 of Mycobacterium tuberculosis by pyrazinamide.
Mol.Microbiol., 95, 2015
8H4I
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BU of 8h4i by Molmil
DHA-bound FFAR4 in complex with Gs
Descriptor: DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID, Free fatty acid receptor 4, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:He, Y, Yin, H.
Deposit date:2022-10-10
Release date:2023-06-21
Last modified:2023-08-09
Method:ELECTRON MICROSCOPY (3.06 Å)
Cite:Structural basis of omega-3 fatty acid receptor FFAR4 activation and G protein coupling selectivity.
Cell Res., 33, 2023
8H4L
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BU of 8h4l by Molmil
DHA-bound FFAR4 in complex with Gq
Descriptor: DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID, Free fatty acid receptor 4, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:He, Y, Yin, H.
Deposit date:2022-10-10
Release date:2023-06-21
Last modified:2023-08-09
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:Structural basis of omega-3 fatty acid receptor FFAR4 activation and G protein coupling selectivity.
Cell Res., 33, 2023
8H4K
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BU of 8h4k by Molmil
GW9508-bound FFAR4 in complex with Gq
Descriptor: 3-(4-{[(3-phenoxyphenyl)methyl]amino}phenyl)propanoic acid, Free fatty acid receptor 4, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:He, Y, Yin, H.
Deposit date:2022-10-10
Release date:2023-06-21
Last modified:2023-08-09
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Structural basis of omega-3 fatty acid receptor FFAR4 activation and G protein coupling selectivity.
Cell Res., 33, 2023
8IAZ
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BU of 8iaz by Molmil
Cryo-EM structure of the ISFba1 TnpB-reRNA-dsDNA complex
Descriptor: DNA (5'-D(P*AP*CP*AP*TP*GP*GP*AP*CP*CP*AP*TP*CP*AP*GP*CP*TP*CP*CP*TP*AP*AP*TP*GP*G)-3'), DNA (5'-D(P*CP*CP*AP*TP*TP*AP*GP*GP*AP*GP*CP*TP*GP*AP*TP*G)-3'), RNA (207-MER), ...
Authors:Yin, M, Zhou, F, Zhu, Y, Huang, Z.
Deposit date:2023-02-09
Release date:2024-04-17
Last modified:2024-05-15
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Discovery and structural mechanism of DNA endonucleases guided by RAGATH-18-derived RNAs.
Cell Res., 34, 2024
5YJ5
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BU of 5yj5 by Molmil
structure for wildtype Human prion protein (M129)
Descriptor: Major prion protein
Authors:Zheng, Z, Lin, D.
Deposit date:2017-10-08
Release date:2018-04-11
Last modified:2019-04-24
Method:SOLUTION NMR
Cite:Structural basis for the complete resistance of the human prion protein mutant G127V to prion disease.
Sci Rep, 8, 2018
5YJ4
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BU of 5yj4 by Molmil
structure for the protective mutant G127V of Human prion protein
Descriptor: Major prion protein
Authors:Zheng, Z, Lin, D.
Deposit date:2017-10-07
Release date:2018-04-11
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Structural basis for the complete resistance of the human prion protein mutant G127V to prion disease.
Sci Rep, 8, 2018
8JW4
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BU of 8jw4 by Molmil
Cryo-EM structure of Plasmodium falciparum multidrug resistance protein 1 in the apo state without H1 helix
Descriptor: Multidrug resistance protein 1
Authors:Li, M, Si, K.
Deposit date:2023-06-28
Release date:2023-08-30
Method:ELECTRON MICROSCOPY (3.13 Å)
Cite:The structure of Plasmodium falciparum multidrug resistance protein 1 reveals an N-terminal regulatory domain.
Proc.Natl.Acad.Sci.USA, 120, 2023
8JWG
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BU of 8jwg by Molmil
Cryo-EM structure of Plasmodium falciparum multidrug resistance protein 1 without H1 helix in complex with MFQ
Descriptor: Mefloquine, Multidrug resistance protein 1
Authors:Li, M, Si, K.
Deposit date:2023-06-29
Release date:2023-08-30
Method:ELECTRON MICROSCOPY (3.54 Å)
Cite:The structure of Plasmodium falciparum multidrug resistance protein 1 reveals an N-terminal regulatory domain.
Proc.Natl.Acad.Sci.USA, 120, 2023
8JWI
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BU of 8jwi by Molmil
Cryo-EM structure of the outward-facing Plasmodium falciparum multidrug resistance protein 1
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, Multidrug resistance protein 1
Authors:Li, M, Si, K.
Deposit date:2023-06-29
Release date:2023-08-30
Method:ELECTRON MICROSCOPY (2.94 Å)
Cite:The structure of Plasmodium falciparum multidrug resistance protein 1 reveals an N-terminal regulatory domain.
Proc.Natl.Acad.Sci.USA, 120, 2023
8JWF
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BU of 8jwf by Molmil
Cryo-EM structure of Plasmodium falciparum multidrug resistance protein 1 with H1 helix in complex with MFQ
Descriptor: Mefloquine, Multidrug resistance protein 1
Authors:Li, M, Si, K.
Deposit date:2023-06-29
Release date:2023-08-30
Method:ELECTRON MICROSCOPY (3.64 Å)
Cite:The structure of Plasmodium falciparum multidrug resistance protein 1 reveals an N-terminal regulatory domain.
Proc.Natl.Acad.Sci.USA, 120, 2023
8JVH
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BU of 8jvh by Molmil
Cryo-EM structure of Plasmodium falciparum multidrug resistance protein 1 in the apo state with H1 helix
Descriptor: Multidrug resistance protein 1
Authors:Li, M, Si, K.
Deposit date:2023-06-28
Release date:2023-08-30
Method:ELECTRON MICROSCOPY (3.19 Å)
Cite:The structure of Plasmodium falciparum multidrug resistance protein 1 reveals an N-terminal regulatory domain.
Proc.Natl.Acad.Sci.USA, 120, 2023
8KAE
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BU of 8kae by Molmil
16d-bound human SPNS2
Descriptor: 3-[3-(4-decylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine, NbFab chain L, NbFab-H chain, ...
Authors:He, Y, Duan, Y.
Deposit date:2023-08-03
Release date:2024-01-03
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (3.18 Å)
Cite:Structural basis of Sphingosine-1-phosphate transport via human SPNS2.
Cell Res., 34, 2024
8JXT
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BU of 8jxt by Molmil
Histamine-bound H4R/Gi complex
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(i) subunit alpha-1, ...
Authors:He, Y, Xia, R.
Deposit date:2023-07-01
Release date:2024-03-20
Last modified:2024-04-03
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:Structural basis of ligand recognition and design of antihistamines targeting histamine H 4 receptor.
Nat Commun, 15, 2024
8JXX
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BU of 8jxx by Molmil
Clobenpropit-bound H4R/Gi complex
Descriptor: 3-(1~{H}-imidazol-4-yl)propyl ~{N}'-[(4-chlorophenyl)methyl]carbamimidothioate, 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, ...
Authors:He, Y, Xia, R.
Deposit date:2023-07-01
Release date:2024-03-20
Last modified:2024-04-03
Method:ELECTRON MICROSCOPY (3.06 Å)
Cite:Structural basis of ligand recognition and design of antihistamines targeting histamine H 4 receptor.
Nat Commun, 15, 2024
8JXW
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BU of 8jxw by Molmil
VUF6884-bound H4R/Gi complex
Descriptor: 2-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepine, 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, ...
Authors:He, Y, Xia, R.
Deposit date:2023-07-01
Release date:2024-03-20
Last modified:2024-04-03
Method:ELECTRON MICROSCOPY (3.01 Å)
Cite:Structural basis of ligand recognition and design of antihistamines targeting histamine H 4 receptor.
Nat Commun, 15, 2024
8JXV
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BU of 8jxv by Molmil
Clozapine-bound H4R/Gi complex
Descriptor: 3-chloranyl-6-(4-methylpiperazin-1-yl)-11~{H}-benzo[b][1,4]benzodiazepine, 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, ...
Authors:He, Y, Xia, R.
Deposit date:2023-07-01
Release date:2024-03-20
Last modified:2024-04-03
Method:ELECTRON MICROSCOPY (3.21 Å)
Cite:Structural basis of ligand recognition and design of antihistamines targeting histamine H 4 receptor.
Nat Commun, 15, 2024
8JU6
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BU of 8ju6 by Molmil
Structure of human TRPV4 with antagonist GSK279
Descriptor: 1-({(5S,7S)-3-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]-7-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decan-7-yl}methyl)-1H-benzimidazole-6-carbonitrile, Transient receptor potential cation channel subfamily V member 4,3C-GFP
Authors:Fan, J, Lei, X.
Deposit date:2023-06-24
Release date:2024-05-08
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.45 Å)
Cite:Structural Pharmacology of TRPV4 Antagonists.
Adv Sci, 11, 2024
8JU5
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BU of 8ju5 by Molmil
Structure of human TRPV4 with antagonist A1
Descriptor: 4-[(3~{S},4~{S})-4-(aminomethyl)-1-(5-chloranylpyridin-2-yl)sulfonyl-4-oxidanyl-pyrrolidin-3-yl]oxy-2-fluoranyl-benzenecarbonitrile, Transient receptor potential cation channel subfamily V member 4,3C-GFP
Authors:Fan, J, Lei, X.
Deposit date:2023-06-24
Release date:2024-05-08
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.74 Å)
Cite:Structural Pharmacology of TRPV4 Antagonists.
Adv Sci, 11, 2024
8JVI
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BU of 8jvi by Molmil
Structure of human TRPV4 with antagonist A2
Descriptor: Transient receptor potential cation channel subfamily V member 4,3C-GFP, [6-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]pyridin-3-yl]-[(1~{S},5~{R})-3-[5-(trifluoromethyl)pyrimidin-2-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]methanone
Authors:Fan, J, Lei, X.
Deposit date:2023-06-28
Release date:2024-05-08
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.21 Å)
Cite:Structural Pharmacology of TRPV4 Antagonists.
Adv Sci, 11, 2024

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