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8YB4
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Pfr conformer of Arabidopsis thaliana phytochrome B in complex with phytochrome-interacting factor 6
Descriptor: 3-[5-[[(3~{R},4~{R})-3-ethyl-4-methyl-5-oxidanylidene-3,4-dihydropyrrol-2-yl]methyl]-2-[[5-[(4-ethyl-3-methyl-5-oxidanylidene-pyrrol-2-yl)methyl]-3-(3-hydroxy-3-oxopropyl)-4-methyl-1~{H}-pyrrol-2-yl]methyl]-4-methyl-1~{H}-pyrrol-3-yl]propanoic acid, phytochrome B, phytochrome-interacting factor 6
Authors:Wang, Z, Wang, W, Zhao, D, Song, Y, Xu, B, Zhao, J, Wang, J.
Deposit date:2024-02-11
Release date:2024-10-02
Last modified:2024-10-09
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Light-induced remodeling of phytochrome B enables signal transduction by phytochrome-interacting factor.
Cell, 2024
8YAX
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BU of 8yax by Molmil
SARS-CoV-2 DMV nsp3-4 pore complex (full-pore)
Descriptor: Non-structural protein 4, Papain-like protease nsp3
Authors:Huang, Y.X, Zhong, L.J, Zhang, W.X, Ni, T.
Deposit date:2024-02-10
Release date:2024-06-19
Last modified:2024-09-18
Method:ELECTRON MICROSCOPY (4.9 Å)
Cite:Molecular architecture of coronavirus double-membrane vesicle pore complex.
Nature, 633, 2024
8RYK
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BU of 8ryk by Molmil
IL-1beta in complex with macrocyclic peptide hit
Descriptor: Interleukin-1 beta, Macrocyclic peptide
Authors:Rondeau, J.-M, Lehmann, S.
Deposit date:2024-02-09
Release date:2024-05-22
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Ligandability Assessment of IL-1 beta by Integrated Hit Identification Approaches.
J.Med.Chem., 67, 2024
8RYT
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BU of 8ryt by Molmil
Structural characterization of Thogoto Virus nucleoprotein provides insights into RNA encapsidation and assembly
Descriptor: Nucleoprotein
Authors:Roske, Y, Mikirtumov, V, Daumke, O, Kudryashev, M, Dick, A.
Deposit date:2024-02-09
Release date:2024-06-19
Last modified:2024-08-21
Method:ELECTRON MICROSCOPY (18 Å)
Cite:Structural characterization of Thogoto Virus nucleoprotein provides insights into viral RNA encapsidation and RNP assembly.
Structure, 32, 2024
8RYS
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BU of 8rys by Molmil
Human IL-1beta, unliganded
Descriptor: Interleukin-1 beta, SULFATE ION
Authors:Rondeau, J.-M, Lehmann, S.
Deposit date:2024-02-09
Release date:2024-03-06
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.16 Å)
Cite:Ligandability Assessment of IL-1 beta by Integrated Hit Identification Approaches.
J.Med.Chem., 67, 2024
8YAN
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BU of 8yan by Molmil
Crystal structure of a class I PreQ1 riboswitch complexed with a synthetic compound
Descriptor: RNA (33-MER), ~{N},~{N}-dimethyl-2-[(1-methyl-9~{H}-pyrido[3,4-b]indol-7-yl)oxy]ethanamine
Authors:Numata, T, Schneekloth, J.S.
Deposit date:2024-02-09
Release date:2024-09-11
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Mechanistic Analysis of Riboswitch Ligand Interactions Provides Insights into Pharmacological Control over Gene Expression.
Biorxiv, 2024
8YAM
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BU of 8yam by Molmil
Crystal structure of a class I PreQ1 riboswitch complexed with a synthetic compound
Descriptor: 2-[2-(dimethylamino)ethoxy]xanthen-9-one, RNA (33-MER)
Authors:Numata, T, Parmar, S, Schneekloth, J.S.
Deposit date:2024-02-09
Release date:2024-09-11
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Mechanistic Analysis of Riboswitch Ligand Interactions Provides Insights into Pharmacological Control over Gene Expression.
Biorxiv, 2024
8VYL
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BU of 8vyl by Molmil
The structure of Human Hemoglobin in Complex with Nanobody BtNbE11
Descriptor: ACETYL GROUP, Hemoglobin subunit alpha, Hemoglobin subunit beta, ...
Authors:Grinter, R, Binks, S, Fox, D.
Deposit date:2024-02-08
Release date:2024-07-17
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:The structure of a haemoglobin-nanobody complex reveals human beta-subunit-specific interactions.
Febs Lett., 598, 2024
8RXX
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BU of 8rxx by Molmil
CRYO-EM STRUCTURE OF LEISHMANIA MAJOR 80S RIBOSOME WITH A/P/E-site tRNA AND mRNA : LM32Cs3H1 sKO STRAIN
Descriptor: 40S ribosomal protein S12, 40S ribosomal protein S14, 40S ribosomal protein S19-like protein, ...
Authors:Rajan, K.S, Yonath, A.
Deposit date:2024-02-08
Release date:2024-05-15
Last modified:2024-05-22
Method:ELECTRON MICROSCOPY (2.97 Å)
Cite:Structural and mechanistic insights into the function of Leishmania ribosome lacking a single pseudouridine modification.
Cell Rep, 43, 2024
8VY7
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BU of 8vy7 by Molmil
CryoEM structure of Gi-coupled TAS2R14 with cholesterol and an intracellular tastant
Descriptor: 4-methyl-N-[(2M)-2-(1H-tetrazol-5-yl)phenyl]-6-(trifluoromethyl)pyrimidin-2-amine, CHOLESTEROL, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Kim, Y, Gumpper, R.H, Roth, B.L.
Deposit date:2024-02-07
Release date:2024-04-03
Last modified:2024-04-24
Method:ELECTRON MICROSCOPY (2.68 Å)
Cite:Bitter taste receptor activation by cholesterol and an intracellular tastant.
Nature, 628, 2024
8VY9
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BU of 8vy9 by Molmil
CryoEM structure of Ggust-coupled TAS2R14 with cholesterol and an intracellular tastant
Descriptor: 4-methyl-N-[(2M)-2-(1H-tetrazol-5-yl)phenyl]-6-(trifluoromethyl)pyrimidin-2-amine, CHOLESTEROL, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Kim, Y, Gumpper, R.H, Roth, B.L.
Deposit date:2024-02-07
Release date:2024-04-03
Last modified:2024-04-24
Method:ELECTRON MICROSCOPY (2.88 Å)
Cite:Bitter taste receptor activation by cholesterol and an intracellular tastant.
Nature, 628, 2024
8RXH
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BU of 8rxh by Molmil
CRYO-EM STRUCTURE OF LEISHMANIA MAJOR 80S RIBOSOME WITH A/P/E-site tRNA AND mRNA : PARENTAL STRAIN
Descriptor: (2S)-2-[2-[4-[[(2R,3S,4S)-3-acetyloxy-4-oxidanyl-pyrrolidin-2-yl]methyl]phenoxy]ethanoylamino]-6-azanyl-hexanoic acid, 40S ribosomal protein S12, 40S ribosomal protein S14, ...
Authors:Rajan, K.S, Yonath, A.
Deposit date:2024-02-07
Release date:2024-05-15
Last modified:2024-05-22
Method:ELECTRON MICROSCOPY (2.93 Å)
Cite:Structural and mechanistic insights into the function of Leishmania ribosome lacking a single pseudouridine modification.
Cell Rep, 43, 2024
8Y9V
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BU of 8y9v by Molmil
ZIKV NS2B/NS3 protease
Descriptor: DAR-LYS-ORN-ARG, Serine protease NS3, Serine protease subunit NS2B
Authors:Zhang, C.Y, Xu, Q, Wang, W.W, Zhou, H, Wang, Q.S.
Deposit date:2024-02-07
Release date:2024-02-28
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystallographic data collection using a multilayer monochromator on an undulator beamline at SSRF
To Be Published
8RXR
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BU of 8rxr by Molmil
Crystal structure of VPS34 in complex with inhibitor SB02024
Descriptor: 4-[(3R)-3-methylmorpholin-4-yl]-2-[(2R)-2-(trifluoromethyl)piperidin-1-yl]-3H-pyridin-6-one, DI(HYDROXYETHYL)ETHER, DIMETHYL SULFOXIDE, ...
Authors:Tresaugues, L, Yu, Y, Bogdan, M, Parpal, S, Silvander, C, Lindstrom, J, Simeon, J, Timson, M.J, Al-Hashimi, H, Smith, B.D, Flynn, D.L, Viklund, J, Martinsson, J, De Milito, A, Andersson, M.
Deposit date:2024-02-07
Release date:2024-03-20
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Combining VPS34 inhibitors with STING agonists enhances type I interferon signaling and anti-tumor efficacy.
Mol Oncol, 18, 2024
8VXU
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BU of 8vxu by Molmil
Crystal structure of Gdx-Clo A60T from Small Multidrug Resistance family of transporters in complex with cetyltrimetylammonium
Descriptor: CETYL-TRIMETHYL-AMMONIUM, L10 Monobody, Multidrug resistance protein, ...
Authors:Burata, O.E, Stockbridge, R.B.
Deposit date:2024-02-06
Release date:2024-05-08
Last modified:2024-06-26
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Peripheral positions encode transport specificity in the small multidrug resistance exporters.
Proc.Natl.Acad.Sci.USA, 121, 2024
8VY4
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BU of 8vy4 by Molmil
Engineering a Tumor-Selective Prodrug T Cell Engager Bispecific Antibody for Safer Immunotherapy
Descriptor: Fab Heavy Chain, Fab Light Chain, PCA-ASP-GLY-ASN-GLU-GLU-MET
Authors:Antonysamy, S, Demarest, S, Froning, K, Hickey, M.H, Kuhlman, B, McCue, A.C.
Deposit date:2024-02-06
Release date:2024-07-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Engineering a tumor-selective prodrug T-cell engager bispecific antibody for safer immunotherapy.
Mabs, 16, 2024
8RX1
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BU of 8rx1 by Molmil
CryoEM structure of the gTuRC-CM1dim complex
Descriptor: Actin b, CM1, Gamma-tubulin complex component 2, ...
Authors:Llorca, O, Serna, M, Gonzalez-Rodriguez, N.
Deposit date:2024-02-06
Release date:2024-09-25
Last modified:2024-10-09
Method:ELECTRON MICROSCOPY (3.57 Å)
Cite:CDK5RAP2 activates microtubule nucleator gamma TuRC by facilitating template formation and actin release.
Dev.Cell, 2024
8RX7
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BU of 8rx7 by Molmil
LTA4 hydrolase in complex with compound2
Descriptor: 5-(4-phenoxyphenyl)-1~{H}-imidazole, ACETATE ION, IMIDAZOLE, ...
Authors:Srinivas, H.
Deposit date:2024-02-06
Release date:2024-03-20
Last modified:2024-04-10
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structure-Guided Elaboration of a Fragment-Like Hit into an Orally Efficacious Leukotriene A4 Hydrolase Inhibitor.
J.Med.Chem., 67, 2024
8RX9
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BU of 8rx9 by Molmil
LTA4 hydrolase in complex with compound3
Descriptor: 1-[[5-[5-(1~{H}-pyrazol-5-yl)pyridin-2-yl]oxypyridin-2-yl]methyl]piperidin-4-ol, ACETATE ION, IMIDAZOLE, ...
Authors:Srinivas, H.
Deposit date:2024-02-06
Release date:2024-03-20
Last modified:2024-04-10
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structure-Guided Elaboration of a Fragment-Like Hit into an Orally Efficacious Leukotriene A4 Hydrolase Inhibitor.
J.Med.Chem., 67, 2024
8RX3
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BU of 8rx3 by Molmil
LTA4 hydrolase in complex with CTX-4430
Descriptor: 4-[[(1~{S},4~{S})-5-[[4-[4-(1,3-oxazol-2-yl)phenoxy]phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]benzoic acid, ACETATE ION, IMIDAZOLE, ...
Authors:Srinivas, H.
Deposit date:2024-02-06
Release date:2024-03-20
Last modified:2024-04-10
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structure-Guided Elaboration of a Fragment-Like Hit into an Orally Efficacious Leukotriene A4 Hydrolase Inhibitor.
J.Med.Chem., 67, 2024
8Y86
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BU of 8y86 by Molmil
Human AE3 with NaHCO3-
Descriptor: Anion exchange protein 3, BICARBONATE ION
Authors:Jian, L, Zhang, Q, Yao, D, Cao, Y.
Deposit date:2024-02-06
Release date:2024-07-31
Last modified:2024-08-07
Method:ELECTRON MICROSCOPY (2.75 Å)
Cite:The structural insight into the functional modulation of human anion exchanger 3.
Nat Commun, 15, 2024
8Y8K
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BU of 8y8k by Molmil
The structure of hAE3
Descriptor: Anion exchange protein 3
Authors:Jian, L, Zhang, Q, Yao, D, Wang, Q, Xia, Y, Qin, A, Cao, Y.
Deposit date:2024-02-06
Release date:2024-07-31
Last modified:2024-08-07
Method:ELECTRON MICROSCOPY (2.89 Å)
Cite:The structural insight into the functional modulation of human anion exchanger 3.
Nat Commun, 15, 2024
8RXB
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BU of 8rxb by Molmil
Human UPF1 CH domain in complex with SMG6 peptide
Descriptor: Regulator of nonsense transcripts 1, Telomerase-binding protein EST1A, ZINC ION
Authors:Langer, L, Basquin, J, Conti, E.
Deposit date:2024-02-06
Release date:2024-05-15
Last modified:2024-06-19
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:UPF1 helicase orchestrates mutually exclusive interactions with the SMG6 endonuclease and UPF2.
Nucleic Acids Res., 52, 2024
8VXQ
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BU of 8vxq by Molmil
Cryo-EM structure of phage DEV ejection proteins gp72:gp73
Descriptor: N4 gp52-like protein, gp72
Authors:Iglesias, S.M, Cingolani, G.
Deposit date:2024-02-05
Release date:2024-04-03
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Integrative structural analysis of Pseudomonas phage DEV reveals a genome ejection motor.
Res Sq, 2024
8RX0
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BU of 8rx0 by Molmil
(NEDD8)-CRL2VHL-MZ1-Brd4BD2-Ub(G76S, K48C)-UBE2R1(C93K, S138C, C191S, C223S)-Ub
Descriptor: (2~{S},4~{R})-1-[(2~{S})-2-[2-[2-[2-[2-[2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaen-9-yl]ethanoylamino]ethoxy]ethoxy]ethoxy]ethanoylamino]-3,3-dimethyl-butanoyl]-~{N}-[[4-(4-methyl-2,3-dihydro-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide, Cullin-2, E3 ubiquitin-protein ligase RBX1, ...
Authors:Crowe, C, Nakasone, M.A, Ciulli, A.
Deposit date:2024-02-05
Release date:2024-03-06
Last modified:2024-09-04
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:(NEDD8)-CRL2VHL-MZ1-Brd4BD2-Ub(G76S, K48C)-UBE2R1(C93K, S138C, C191S, C223S)-Ub
To Be Published

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PDB entries from 2024-10-09

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