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8XQP
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BU of 8xqp by Molmil
Structure of human class T GPCR TAS2R14-Gustducin complex with Aristolochic acid A.
Descriptor: 8-methoxy-6-nitro-naphtho[1,2-e][1,3]benzodioxole-5-carboxylic acid, CHOLESTEROL, Exo-alpha-sialidase,Taste receptor type 2 member 14,LgBiT, ...
Authors:Hu, X.L, Wu, L.J, Hua, T, Liu, Z.J.
Deposit date:2024-01-05
Release date:2024-07-10
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.29 Å)
Cite:Bitter taste TAS2R14 activation by intracellular tastants and cholesterol.
Nature, 631, 2024
8XEA
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BU of 8xea by Molmil
XBB.1.5 spike protein in complex with BD55-1205
Descriptor: BD55-1205 heavy chain, BD55-1205 light chain, Spike glycoprotein
Authors:Feng, L.L.
Deposit date:2023-12-11
Release date:2024-04-24
Method:ELECTRON MICROSCOPY (3.42 Å)
Cite:XBB.1.5 spike protein in complex with BD55-1205
To Be Published
4BCJ
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BU of 4bcj by Molmil
Structure of CDK9 in complex with cyclin T and a 2-amino-4-heteroaryl- pyrimidine inhibitor
Descriptor: 2-[(3-hydroxyphenyl)amino]-4-[4-methyl-2-(methylamino)-1,3-thiazol-5-yl]pyrimidine-5-carbonitrile, CYCLIN-DEPENDENT KINASE 9, CYCLIN-T1
Authors:Hole, A.J, Baumli, S, Wang, S, Endicott, J.A, Noble, M.E.M.
Deposit date:2012-10-02
Release date:2013-01-09
Last modified:2019-05-15
Method:X-RAY DIFFRACTION (3.162 Å)
Cite:Comparative Structural and Functional Studies of 4-(Thiazol- 5-Yl)-2-(Phenylamino)Pyrimidine-5-Carbonitrile Cdk9 Inhibitors Suggest the Basis for Isotype Selectivity.
J.Med.Chem., 56, 2013
8XZP
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BU of 8xzp by Molmil
Crystal structure of folE riboswitch with 8-CH3 Guanine
Descriptor: 2-azanyl-8-methyl-1,9-dihydropurin-6-one, MAGNESIUM ION, RNA (53-MER), ...
Authors:Li, C.Y, Ren, A.M.
Deposit date:2024-01-21
Release date:2024-07-24
Method:X-RAY DIFFRACTION (2.18 Å)
Cite:Structure-based characterization and compound identification of the wild-type THF class-II riboswitch.
Nucleic Acids Res., 2024
8YXA
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BU of 8yxa by Molmil
Crystal structure of the HSA complex with cefazolin and myristate
Descriptor: (6~{R},7~{R})-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxidanylidene-7-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, MYRISTIC ACID, Serum albumin
Authors:Kawai, A.
Deposit date:2024-04-02
Release date:2024-08-07
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Interaction of Cephalosporins with Human Serum Albumin: A Structural Study.
J.Med.Chem., 2024
8YXB
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BU of 8yxb by Molmil
Crystal structure of the HSA complex with ceftriaxone and myristate
Descriptor: Ceftriaxone, MYRISTIC ACID, Serum albumin
Authors:Kawai, A.
Deposit date:2024-04-02
Release date:2024-08-07
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Interaction of Cephalosporins with Human Serum Albumin: A Structural Study.
J.Med.Chem., 2024
8XQS
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BU of 8xqs by Molmil
Structure of human class T GPCR TAS2R14-DNGi complex with Flufenamic acid.
Descriptor: 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID, CHOLESTEROL, Exo-alpha-sialidase,Taste receptor type 2 member 14,LgBiT, ...
Authors:Hu, X.L, Wu, L.J, Hua, T, Liu, Z.J.
Deposit date:2024-01-05
Release date:2024-07-10
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Bitter taste TAS2R14 activation by intracellular tastants and cholesterol.
Nature, 631, 2024
9BDU
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BU of 9bdu by Molmil
NF-kappaB RelA homo-dimer bound to AT-centric kappaB DNA
Descriptor: DNA (5'-D(P*AP*CP*TP*GP*GP*GP*AP*AP*AP*TP*TP*CP*CP*AP*GP*TP*GP*AP*T)-3'), DNA (5'-D(P*AP*TP*CP*AP*CP*TP*GP*GP*AP*AP*TP*TP*TP*CP*CP*CP*AP*GP*T)-3'), SULFATE ION, ...
Authors:Biswas, T, Huang, D, Ghosh, G.
Deposit date:2024-04-12
Release date:2024-04-24
Last modified:2024-06-12
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Transient interactions modulate the affinity of NF-kappa B transcription factors for DNA.
Proc.Natl.Acad.Sci.USA, 121, 2024
8XMC
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BU of 8xmc by Molmil
Post-translocated Pol IV transcription elongation complex
Descriptor: DNA-directed RNA polymerase IV subunit 1, DNA-directed RNA polymerase IV subunit 7, DNA-directed RNA polymerases II and IV subunit 5A, ...
Authors:Huang, K, Fang, C.L, Zhang, Y.
Deposit date:2023-12-27
Release date:2024-07-24
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Transcription of the Plant RNA polymerase IV is prone to backtracking
To Be Published
8ZFJ
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BU of 8zfj by Molmil
cryo-EM structure of GPR4-Gs complex at pH 8.5
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(s) subunit alpha isoforms short, ...
Authors:Ma, Y, Tang, M, Ru, H, Song, G.
Deposit date:2024-05-07
Release date:2024-08-07
Last modified:2024-08-14
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:cryo-EM structure of GPR4-Gs complex at pH 8.5
to be published
8XRT
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BU of 8xrt by Molmil
The crystal structure of a GH3 enzyme CcBgl3B
Descriptor: CALCIUM ION, GH3 enzyme CcBgl3B
Authors:Su, J.Y.
Deposit date:2024-01-08
Release date:2024-04-10
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:A trapped covalent intermediate as a key catalytic element in the hydrolysis of a GH3 beta-glucosidase: An X-ray crystallographic and biochemical study.
Int.J.Biol.Macromol., 265, 2024
4BCK
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BU of 4bck by Molmil
Structure of CDK2 in complex with cyclin A and a 2-amino-4-heteroaryl- pyrimidine inhibitor
Descriptor: 3-[[5-cyano-4-[4-methyl-2-(methylamino)-1,3-thiazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide, CYCLIN-A2, CYCLIN-DEPENDENT KINASE 2, ...
Authors:Hole, A.J, Baumli, S, Wang, S, Endicott, J.A, Noble, M.E.M.
Deposit date:2012-10-02
Release date:2013-03-06
Method:X-RAY DIFFRACTION (2.052 Å)
Cite:Comparative Structural and Functional Studies of 4-(Thiazol- 5-Yl)-2-(Phenylamino)Pyrimidine-5-Carbonitrile Cdk9 Inhibitors Suggest the Basis for Isotype Selectivity.
J.Med.Chem., 56, 2013
8ZSS
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BU of 8zss by Molmil
Cryo-EM structure of the RO5263397-bound hTAAR1-Gs complex
Descriptor: (4~{S})-4-(3-fluoranyl-2-methyl-phenyl)-1,3-oxazolidin-2-amine, 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:Jiang, K.X, Zheng, Y, Xu, F.
Deposit date:2024-06-05
Release date:2024-07-24
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:The versatile binding landscape of the TAAR1 pocket for LSD and other antipsychotic drug molecules.
Cell Rep, 43, 2024
8XOF
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BU of 8xof by Molmil
Cryo-EM structure of Lys05 bound GPR30-Gq complex structure
Descriptor: G protein subunit q, G-protein coupled estrogen receptor 1, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Liu, H, Xu, P, Xu, H.E.
Deposit date:2024-01-01
Release date:2024-04-10
Last modified:2024-07-10
Method:ELECTRON MICROSCOPY (2.6 Å)
Cite:Structural and functional evidence that GPR30 is not a direct estrogen receptor.
Cell Res., 34, 2024
8XQN
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BU of 8xqn by Molmil
Structure of human class T GPCR TAS2R14-DNGi complex with Aristolochic acid A.
Descriptor: 8-methoxy-6-nitro-naphtho[1,2-e][1,3]benzodioxole-5-carboxylic acid, CHOLESTEROL, Exo-alpha-sialidase,Taste receptor type 2 member 14,LgBiT, ...
Authors:Hu, X.L, Wu, L.J, Hua, T, Liu, Z.J.
Deposit date:2024-01-05
Release date:2024-07-10
Last modified:2024-07-31
Method:ELECTRON MICROSCOPY (3.05 Å)
Cite:Bitter taste TAS2R14 activation by intracellular tastants and cholesterol.
Nature, 631, 2024
6WIL
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BU of 6wil by Molmil
CdiB from Acinetobacter baumannii
Descriptor: (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE, DI(HYDROXYETHYL)ETHER, Hemolysin activator protein CdiB, ...
Authors:Guerin, J, Botos, I, Buchanan, S.K.
Deposit date:2020-04-10
Release date:2020-11-04
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural insight into toxin secretion by contact dependent growth inhibition transporters.
Elife, 9, 2020
8YDB
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BU of 8ydb by Molmil
Type I-FHNH Cascade-dsDNA intermediate complex
Descriptor: 60-nt crRNA, Cas5f, Cas6f, ...
Authors:Li, Z.
Deposit date:2024-02-19
Release date:2024-07-31
Last modified:2024-08-07
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Mechanisms for HNH-mediated target DNA cleavage in type I CRISPR-Cas systems.
Mol.Cell, 2024
8XDR
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BU of 8xdr by Molmil
O-methyltransferase from Lycoris aurea complexed with Mg, SAH, and 3,4-dihydroxybenzaldehyde
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLYCEROL, MAGNESIUM ION, ...
Authors:Saw, Y.Y.H, Nakashima, Y, Morita, H.
Deposit date:2023-12-11
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Structure-Based Catalytic Mechanism of Amaryllidaceae O-Methyltransferases
Acs Catalysis, 2024
8YV8
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BU of 8yv8 by Molmil
Cryo-EM structure of CDCA7 bound to nucleosome including hemimethylated CpG site in Widom601 positioning sequence.
Descriptor: Cell division cycle-associated protein 7, DNA (132-MER), Histone H2A type 1-B/E, ...
Authors:Kikuchi, A, Shikimachi, R, Nishiyama, A, Funabiki, H, Arita, K.
Deposit date:2024-03-28
Release date:2024-07-31
Method:ELECTRON MICROSCOPY (3 Å)
Cite:CDCA7 is a hemimethylated DNA adaptor for the nucleosome remodeler HELLS
To Be Published
8YJA
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BU of 8yja by Molmil
Structure of Vibrio vulnificus MARTX cysteine protease domain lacking beta-flap
Descriptor: INOSITOL HEXAKISPHOSPHATE, MARTX cysteine protease domain, SODIUM ION
Authors:Chen, L, Khan, H, Tan, L, Li, X, Zhang, G, Im, Y.J.
Deposit date:2024-03-01
Release date:2024-07-10
Last modified:2024-08-14
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural basis of the activation of MARTX cysteine protease domain from Vibrio vulnificus.
Plos One, 19, 2024
8X8P
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BU of 8x8p by Molmil
Phenylethanol rhamnosyltransferase (CmGT3)
Descriptor: 1,2-ETHANEDIOL, Phenylethanol rhamnosyltransferase (CmGT3)
Authors:Wang, H.T, Wang, Z.L, Ye, M.
Deposit date:2023-11-28
Release date:2024-04-17
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:Structure of Phenylethanol rhamnosyltransferase(CmGT3)
To Be Published
9LDT
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BU of 9ldt by Molmil
DESIGN AND SYNTHESIS OF NEW ENZYMES BASED ON THE LACTATE DEHYDROGENASE FRAMEWORK
Descriptor: LACTATE DEHYDROGENASE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, OXAMIC ACID, ...
Authors:Dunn, C.R, Holbrook, J.J, Muirhead, H.
Deposit date:1991-11-26
Release date:1993-10-31
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2 Å)
Cite:Design and synthesis of new enzymes based on the lactate dehydrogenase framework.
Philos.Trans.R.Soc.London,Ser.B, 332, 1991
8XAK
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BU of 8xak by Molmil
Structure of Pif1-G4 complex
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ATP-dependent DNA helicase PIF1, DNA (34-MER), ...
Authors:Hong, Z, Song, H.
Deposit date:2023-12-04
Release date:2024-07-31
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Eukaryotic Pif1 helicase unwinds G-quadruplex and dsDNA using a conserved wedge.
Nat Commun, 15, 2024
9LPR
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BU of 9lpr by Molmil
STRUCTURAL BASIS FOR BROAD SPECIFICITY IN ALPHA-LYTIC PROTEASE MUTANTS
Descriptor: ALPHA-LYTIC PROTEASE, METHOXYSUCCINYL-ALA-ALA-PRO-LEUCINE BORONIC ACID INHIBITOR, SULFATE ION
Authors:Bone, R, Agard, D.A.
Deposit date:1991-08-05
Release date:1993-01-15
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural basis for broad specificity in alpha-lytic protease mutants.
Biochemistry, 30, 1991
8Y6H
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BU of 8y6h by Molmil
P-glycoprotein in complex with UIC2 Fab and triple elacridar molecules in LMNG detergent
Descriptor: ATP-dependent translocase ABCB1,mNeonGreen, UIC2 Fab heavy chain, UIC2 Fab light chain, ...
Authors:Hamaguchi-Suzuki, N, Adachi, N, Moriya, T, Kawasaki, M, Suzuki, K, Anzai, N, Senda, T, Murata, T.
Deposit date:2024-02-02
Release date:2024-04-17
Method:ELECTRON MICROSCOPY (2.49 Å)
Cite:Cryo-EM structure of P-glycoprotein bound to triple elacridar inhibitor molecules.
Biochem.Biophys.Res.Commun., 709, 2024

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