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5XPN
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BU of 5xpn by Molmil
Crystal structure of VDR-LBD complexed with 25RS-(hydroxyphenyl)-25-methoxy-2-methylidene-19,26,27-trinor-1-hydroxyvitamin D3
Descriptor: (1~{R},3~{R})-5-[(2~{E})-2-[(1~{R},3~{a}~{S},7~{a}~{R})-1-[(2~{R},6~{R})-6-(4-hydroxyphenyl)-6-methoxy-hexan-2-yl]-7~{a}-methyl-2,3,3~{a},5,6,7-hexahydro-1~{H}-inden-4-ylidene]ethylidene]-2-methylidene-cyclohexane-1,3-diol, (1~{R},3~{R})-5-[(2~{E})-2-[(1~{R},3~{a}~{S},7~{a}~{R})-1-[(2~{R},6~{S})-6-(4-hydroxyphenyl)-6-methoxy-hexan-2-yl]-7~{a}-methyl-2,3,3~{a},5,6,7-hexahydro-1~{H}-inden-4-ylidene]ethylidene]-2-methylidene-cyclohexane-1,3-diol, Mediator of RNA polymerase II transcription subunit 1, ...
Authors:Kato, A, Itoh, T, Yamamoto, K.
Deposit date:2017-06-03
Release date:2018-07-11
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Vitamin D Analogues with a p-Hydroxyphenyl Group at the C25 Position: Crystal Structure of Vitamin D Receptor Ligand-Binding Domain Complexed with the Ligand Explains the Mechanism Underlying Full Antagonistic Action
J. Med. Chem., 60, 2017
3BX1
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BU of 3bx1 by Molmil
Complex between the Barley alpha-Amylase/Subtilisin Inhibitor and the subtilisin Savinase
Descriptor: Alpha-amylase/subtilisin inhibitor, CALCIUM ION, CHLORIDE ION, ...
Authors:Micheelsen, P.O, Vevodova, J, Wilson, K, Skjot, M.
Deposit date:2008-01-11
Release date:2008-07-08
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structural and Mutational Analyses of the Interaction between the Barley alpha-Amylase/Subtilisin Inhibitor and the Subtilisin Savinase Reveal a Novel Mode of Inhibition
J.Mol.Biol., 380, 2008
4DRB
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BU of 4drb by Molmil
The crystal structure of FANCM bound MHF complex
Descriptor: Centromere protein S, Centromere protein X, Fanconi anemia group M protein
Authors:Tao, Y, Niu, L, Teng, M.
Deposit date:2012-02-17
Release date:2012-05-16
Method:X-RAY DIFFRACTION (2.634 Å)
Cite:The structure of the FANCM-MHF complex reveals physical features for functional assembly
Nat Commun, 3, 2012
5XJU
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BU of 5xju by Molmil
Crystal Structure of the Gemin2-binding domain of SMN, Gemin2dN39 in Complex with SmD1(1-82)/D2.R61A/F/E/G from Human
Descriptor: Gem-associated protein 2, Small nuclear ribonucleoprotein E, Small nuclear ribonucleoprotein F, ...
Authors:Yi, H, Zhang, R.
Deposit date:2017-05-04
Release date:2018-07-04
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.58 Å)
Cite:Structures of 7S mutant complexes.
To Be Published
5XPM
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BU of 5xpm by Molmil
Crystal structure of VDR-LBD complexed with 22S-Butyl-25RS-(hydroxyphenyl)-25-methoxy-2-methylidene-19,26,27-trinor-1-hydroxyvitamin D3
Descriptor: (1~{R},3~{R})-5-[(2~{E})-2-[(1~{R},3~{a}~{S},7~{a}~{R})-1-[(2~{R},3~{S})-3-[(3~{S})-3-(4-hydroxyphenyl)-3-methoxy-propyl]heptan-2-yl]-7~{a}-methyl-2,3,3~{a},5,6,7-hexahydro-1~{H}-inden-4-ylidene]ethylidene]-2-methylidene-cyclohexane-1,3-diol, Mediator of RNA polymerase II transcription subunit 1, Vitamin D3 receptor
Authors:Kato, A, Itoh, T, Yamamoto, K.
Deposit date:2017-06-03
Release date:2018-06-06
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Vitamin D Analogues with a p-Hydroxyphenyl Group at the C25 Position: Crystal Structure of Vitamin D Receptor Ligand-Binding Domain Complexed with the Ligand Explains the Mechanism Underlying Full Antagonistic Action
J. Med. Chem., 60, 2017
6G1V
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BU of 6g1v by Molmil
Crystal structure of Torpedo Californica acetylcholinesterase in complex with 12-Amino-3-chloro-6,7,10,11-tetrahydro-5,9-dimethyl-7,11-methanocycloocta[b]quinolin-5-ium
Descriptor: 12-Amino-3-chloro-6,7,10,11-tetrahydro-5,9-dimethyl-7,11-methanocycloocta[b]quinolin-5-ium, 2-acetamido-2-deoxy-beta-D-glucopyranose, Acetylcholinesterase, ...
Authors:Coquelle, N, Colletier, J.P.
Deposit date:2018-03-22
Release date:2018-04-04
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Increasing Polarity in Tacrine and Huprine Derivatives: Potent Anticholinesterase Agents for the Treatment of Myasthenia Gravis.
Molecules, 23, 2018
5V6E
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BU of 5v6e by Molmil
Crystal structure of Myosin VI in complex with GH2 domain of GIPC1
Descriptor: PDZ domain-containing protein GIPC1, Unconventional myosin-VI
Authors:Shang, G, Zhang, X.
Deposit date:2017-03-16
Release date:2017-05-31
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (3.506 Å)
Cite:Structure analyses reveal a regulated oligomerization mechanism of the PlexinD1/GIPC/myosin VI complex.
Elife, 6, 2017
5V6T
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BU of 5v6t by Molmil
The Plexin D1 intracellular region in complex with GIPC1
Descriptor: PDZ domain-containing protein GIPC1, Plexin-D1, SULFATE ION
Authors:Shang, G, Zhang, X.
Deposit date:2017-03-17
Release date:2017-05-31
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (3.189 Å)
Cite:Structure analyses reveal a regulated oligomerization mechanism of the PlexinD1/GIPC/myosin VI complex.
Elife, 6, 2017
6EHP
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BU of 6ehp by Molmil
The crystal structure of the human LAMTOR complex
Descriptor: CHLORIDE ION, Ragulator complex protein LAMTOR1, Ragulator complex protein LAMTOR2, ...
Authors:Scheffzek, K, Naschberger, A.
Deposit date:2017-09-14
Release date:2017-10-04
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of the human lysosomal mTORC1 scaffold complex and its impact on signaling.
Science, 358, 2017
7ND1
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BU of 7nd1 by Molmil
First-in-class small molecule inhibitors of Polycomb Repressive Complex 1 (PRC1) RING domain
Descriptor: 3-(2-chlorophenyl)-4-ethyl-5-(1~{H}-indol-4-yl)-1~{H}-pyrrole-2-carboxylic acid, E3 ubiquitin-protein ligase RING2, Polycomb complex protein BMI-1, ...
Authors:Cierpicki, T, Lund, G, Jaremko, L.
Deposit date:2021-01-29
Release date:2021-06-16
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Small-molecule inhibitors targeting Polycomb repressive complex 1 RING domain.
Nat.Chem.Biol., 17, 2021
5W7I
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BU of 5w7i by Molmil
X-ray structure of ankyrin repeat domain of DHHC17 in complex with Snap25b peptide
Descriptor: Palmitoyltransferase ZDHHC17, Snap25b-111-120
Authors:Verardi, R, Kim, J.-S, Ghirlando, R, Banerjee, A.
Deposit date:2017-06-20
Release date:2017-08-09
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.105 Å)
Cite:Structural Basis for Substrate Recognition by the Ankyrin Repeat Domain of Human DHHC17 Palmitoyltransferase.
Structure, 25, 2017
5W7J
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BU of 5w7j by Molmil
X-ray structure of the E89A variant of ankyrin repeat domain of DHHC17 in complex with Snap25b peptide
Descriptor: Palmitoyltransferase ZDHHC17, Snap25b-111-120
Authors:Verardi, R, Kim, J.-S, Ghirlando, R, Banerjee, A.
Deposit date:2017-06-20
Release date:2017-08-09
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.202 Å)
Cite:Structural Basis for Substrate Recognition by the Ankyrin Repeat Domain of Human DHHC17 Palmitoyltransferase.
Structure, 25, 2017
5V6B
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BU of 5v6b by Molmil
Crystal structure of GIPC1
Descriptor: PDZ domain-containing protein GIPC1
Authors:Shang, G, Zhang, X.
Deposit date:2017-03-16
Release date:2017-05-31
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure analyses reveal a regulated oligomerization mechanism of the PlexinD1/GIPC/myosin VI complex.
Elife, 6, 2017
5X0W
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BU of 5x0w by Molmil
Molecular mechanism for the binding between Sharpin and HOIP
Descriptor: E3 ubiquitin-protein ligase RNF31, Sharpin
Authors:Liu, J, Li, F, Cheng, X, Pan, L.
Deposit date:2017-01-23
Release date:2017-10-18
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structural Insights into SHARPIN-Mediated Activation of HOIP for the Linear Ubiquitin Chain Assembly
Cell Rep, 21, 2017
7NRN
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BU of 7nrn by Molmil
NMR structure of GIPC1-GH2 domain
Descriptor: PDZ domain-containing protein GIPC1
Authors:Barthe, P, Roumestand, C.
Deposit date:2021-03-04
Release date:2021-04-14
Last modified:2024-06-19
Method:SOLUTION NMR
Cite:Pressure and Chemical Unfolding of an alpha-Helical Bundle Protein: The GH2 Domain of the Protein Adaptor GIPC1.
Int J Mol Sci, 22, 2021
8HBM
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BU of 8hbm by Molmil
Structural basis of the farnesoid X receptor/retinoid X receptor heterodimer on inverted repeat DNA
Descriptor: Bile acid receptor, DNA (5'-D(P*CP*CP*GP*AP*GP*GP*TP*CP*AP*AP*TP*GP*AP*CP*CP*TP*CP*G)-3'), DNA (5'-D(P*CP*CP*GP*AP*GP*GP*TP*CP*AP*TP*TP*GP*AP*CP*CP*TP*CP*G)-3'), ...
Authors:Jiang, L, Chen, Y.
Deposit date:2022-10-29
Release date:2023-06-14
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Structural basis of the farnesoid X receptor/retinoid X receptor heterodimer on inverted repeat DNA.
Comput Struct Biotechnol J, 21, 2023
8H3Q
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BU of 8h3q by Molmil
Cryo-EM Structure of the CAND1-Cul3-Rbx1 complex
Descriptor: Cullin-3, Cullin-associated NEDD8-dissociated protein 1, E3 ubiquitin-protein ligase RBX1, ...
Authors:Hu, Y, Mao, Q, Chen, Z, Sun, L.
Deposit date:2022-10-09
Release date:2023-10-11
Last modified:2024-03-20
Method:ELECTRON MICROSCOPY (3.76 Å)
Cite:Dynamic molecular architecture and substrate recruitment of cullin3-RING E3 ligase CRL3 KBTBD2.
Nat.Struct.Mol.Biol., 31, 2024
7OXU
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BU of 7oxu by Molmil
VDR complex - calcitroic acid
Descriptor: Mediator of RNA polymerase II transcription subunit 1, Vitamin D3 receptor A, calcitroic acid
Authors:Rochel, N, Arnold, L.A.
Deposit date:2021-06-23
Release date:2022-07-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:VDR complex - calcitroic acid
To Be Published
8BDD
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BU of 8bdd by Molmil
Crystal structure of Bacteroides ovatus CP926 PL17 alginate lyase
Descriptor: Alginate lyase family protein, NICKEL (II) ION
Authors:Roenne, M.E, Tandrup, T, Wilkens, C.
Deposit date:2022-10-19
Release date:2023-08-30
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Three alginate lyases provide a new gut Bacteroides ovatus isolate with the ability to grow on alginate.
Appl.Environ.Microbiol., 89, 2023
8BDQ
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BU of 8bdq by Molmil
Crystal structure of Bacteroides ovatus CP926 PL38 alginate lyase
Descriptor: Alginate lyase family protein, SULFATE ION
Authors:Roenne, M.E, Tandrup, T, Wilkens, C.
Deposit date:2022-10-19
Release date:2023-08-30
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Three alginate lyases provide a new gut Bacteroides ovatus isolate with the ability to grow on alginate.
Appl.Environ.Microbiol., 89, 2023
6CDS
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BU of 6cds by Molmil
Human neurofibromin 2/merlin/schwannomin residues 1-339 in complex with PIP2
Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, Merlin, ...
Authors:Chinthalapudi, K, Sharff, A.J, Bricogne, G, Izard, T.
Deposit date:2018-02-09
Release date:2018-07-18
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:Lipid binding promotes the open conformation and tumor-suppressive activity of neurofibromin 2.
Nat Commun, 9, 2018
6CM9
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BU of 6cm9 by Molmil
Structure of the cargo bound AP-1:Arf1:tetherin-Nef closed trimer monomeric subunit
Descriptor: ADP-ribosylation factor 1, AP-1 complex subunit beta-1, AP-1 complex subunit gamma-1, ...
Authors:Morris, K.L, Buffalo, C.Z, Ren, X, Hurley, J.H.
Deposit date:2018-03-03
Release date:2018-08-08
Last modified:2024-03-13
Method:ELECTRON MICROSCOPY (3.73 Å)
Cite:HIV-1 Nefs Are Cargo-Sensitive AP-1 Trimerization Switches in Tetherin Downregulation.
Cell, 174, 2018
5YK3
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BU of 5yk3 by Molmil
human Ragulator complex
Descriptor: Ragulator complex protein LAMTOR1, Ragulator complex protein LAMTOR2, Ragulator complex protein LAMTOR3, ...
Authors:Wu, G, Mu, Z.
Deposit date:2017-10-12
Release date:2019-01-23
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (3.01 Å)
Cite:Structural insight into the Ragulator complex which anchors mTORC1 to the lysosomal membrane
Cell Discov, 3, 2017
5Y3A
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BU of 5y3a by Molmil
Crystal structure of Ragulator complex (p18 49-161)
Descriptor: Ragulator complex protein LAMTOR1, Ragulator complex protein LAMTOR2, Ragulator complex protein LAMTOR3, ...
Authors:Zhang, T, Ding, J.
Deposit date:2017-07-28
Release date:2017-12-27
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structural basis for Ragulator functioning as a scaffold in membrane-anchoring of Rag GTPases and mTORC1.
Nat Commun, 8, 2017
6CTC
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BU of 6ctc by Molmil
Crystal structure of human transferrin bound to Triferic FPC iron pyrophosphate
Descriptor: CARBONATE ION, FE (III) ION, PYROPHOSPHATE 2-, ...
Authors:Edwards, T.E, Pratt, R.
Deposit date:2018-03-22
Release date:2018-10-24
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Ferric pyrophosphate citrate: interactions with transferrin.
Biometals, 31, 2018

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