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8Z8R
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BU of 8z8r by Molmil
norbelladine 4'-O-methyltransferase S52T complexed with Mg and SAH
Descriptor: GLYCEROL, MAGNESIUM ION, Norbelladine 4'-O-methyltransferase, ...
Authors:Saw, Y.Y.H, Nakashima, Y, Morita, H.
Deposit date:2024-04-22
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Structure-Based Catalytic Mechanism of Amaryllidaceae O-Methyltransferases
Acs Catalysis, 2024
8YPK
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BU of 8ypk by Molmil
mouse proteasome 20S subunit in complex with compound 1
Descriptor: Proteasome subunit alpha type-1, Proteasome subunit alpha type-2, Proteasome subunit alpha type-3, ...
Authors:Kashima, A, Arai, Y.
Deposit date:2024-03-17
Release date:2024-07-31
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Optimization of alpha-amido boronic acids via cryo-electron microscopy analysis: Discovery of a novel highly selective immunoproteasome subunit LMP7 ( beta 5i)/LMP2 ( beta 1i) dual inhibitor.
Bioorg.Med.Chem., 109, 2024
8XXN
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BU of 8xxn by Molmil
Cryo-EM structure of the human 43S ribosome with PDCD4
Descriptor: 18S rRNA, 40S ribosomal protein S10, 40S ribosomal protein S11, ...
Authors:Ye, X, Huang, Z, Li, Y, Wang, M, Cheng, J.
Deposit date:2024-01-18
Release date:2024-05-01
Last modified:2024-07-10
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Human tumor suppressor PDCD4 directly interacts with ribosomes to repress translation.
Cell Res., 34, 2024
8XE2
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BU of 8xe2 by Molmil
O-methyltransferase from Lycoris longituba D230A variant complexed with Mg, SAH, and 3,4-dihydroxybenzaldehyde
Descriptor: GLYCEROL, MAGNESIUM ION, Protocatechuic aldehyde, ...
Authors:Saw, Y.Y.H, Nakashima, Y, Morita, H.
Deposit date:2023-12-11
Release date:2024-08-07
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Structure-Based Catalytic Mechanism of Amaryllidaceae O-Methyltransferases
Acs Catalysis, 2024
9EUS
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BU of 9eus by Molmil
Mpro from SARS-CoV-2 with R298A mutation
Descriptor: GLYCEROL, Replicase polyprotein 1a
Authors:Plewka, J, Lis, K, Czarna, A, Pyrc, K, Kantyka, T, Chykunova, Y.
Deposit date:2024-03-28
Release date:2024-04-17
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:SARS-CoV-2 M pro oligomerization as a potential target for therapy.
Int.J.Biol.Macromol., 267, 2024
9BAP
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BU of 9bap by Molmil
CryoEM structure of Apo-DIM2
Descriptor: DNA (cytosine-5-)-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE, ZINC ION
Authors:Song, J, Shao, Z.
Deposit date:2024-04-04
Release date:2024-07-24
Method:ELECTRON MICROSCOPY (2.88 Å)
Cite:CryoEM structure of Apo-DIM2
To Be Published
8XRH
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BU of 8xrh by Molmil
The crystal structure of AsfvTopII ATPase domain in complex with AMPPNP
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, DNA topoisomerase 2, MAGNESIUM ION, ...
Authors:Yang, J, Gan, J.H.
Deposit date:2024-01-07
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:The crystal structure of AsfvTopII ATPase domain in complex with AMPPNP
Nat Commun, 2024
8XVV
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BU of 8xvv by Molmil
The TRRAP module of human NuA4/TIP60 complex
Descriptor: INOSITOL HEXAKISPHOSPHATE, Isoform 2 of E1A-binding protein p400, Isoform 2 of Transformation/transcription domain-associated protein
Authors:Chen, K, Wang, L, Yu, Z, Yu, J, Ren, Y, Wang, Q, Xu, Y.
Deposit date:2024-01-15
Release date:2024-07-24
Last modified:2024-07-31
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structure of the human TIP60 complex
To Be Published
9EPM
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BU of 9epm by Molmil
Mpro from SARS-CoV-2 with 4A mutation
Descriptor: Non-structural protein 11
Authors:Plewka, J, Lis, K, Czarna, A, Pyrc, K, Kantyka, T, Chykunova, Y.
Deposit date:2024-03-19
Release date:2024-04-17
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (1.981 Å)
Cite:SARS-CoV-2 M pro oligomerization as a potential target for therapy.
Int.J.Biol.Macromol., 267, 2024
8Z8P
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BU of 8z8p by Molmil
norbelladine 4'-O-methyltransferase S52M variant complexed with Mg and SAH
Descriptor: GLYCEROL, MAGNESIUM ION, Norbelladine 4'-O-methyltransferase, ...
Authors:Saw, Y.Y.H, Nakashima, Y, Morita, H.
Deposit date:2024-04-22
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Structure-Based Catalytic Mechanism of Amaryllidaceae O-Methyltransferases
Acs Catalysis, 2024
8YRF
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BU of 8yrf by Molmil
Crystal structure of LmrR with V15 replaced by unnatural amino acid 4-amino-L-phenyl-cysteine
Descriptor: 1,2-ETHANEDIOL, Transcriptional regulator, PadR-like family
Authors:Zhou, Z, Huang, W.
Deposit date:2024-03-21
Release date:2024-04-24
Method:X-RAY DIFFRACTION (2.66 Å)
Cite:Crystal structure of LmrR with V15 replaced by unnatural amino acid 4-amino-L-phenyl-cysteine
To Be Published
8Z8O
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BU of 8z8o by Molmil
norbelladine 4'-O-methyltransferase Y186F complexed with Mg and SAH
Descriptor: GLYCEROL, MAGNESIUM ION, Norbelladine 4'-O-methyltransferase, ...
Authors:Saw, Y.Y.H, Nakashima, Y, Morita, H.
Deposit date:2024-04-22
Release date:2024-08-07
Method:X-RAY DIFFRACTION (1.71 Å)
Cite:Structure-Based Catalytic Mechanism of Amaryllidaceae O-Methyltransferases
Acs Catalysis, 2024
9ARQ
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BU of 9arq by Molmil
Crystal structure of SARS-CoV-2 main protease (authentic protein) in complex with an inhibitor TKB-245
Descriptor: (1R,2S,5S)-N-{(1S,2S)-1-(4-fluoro-1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase nsp5
Authors:Bulut, H, Hattori, S, Hayashi, H, Hasegawa, K, Li, M, Wlodawer, A, Tamamura, H, Mitsuya, H.
Deposit date:2024-02-23
Release date:2024-04-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and virologic mechanism of emergence of main protease inhibitor-resistance in SARS-CoV-2 as selected with main protease inhibitors
To Be Published
9EP4
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BU of 9ep4 by Molmil
Structure of Integrator subcomplex INTS5/8/15
Descriptor: Integrator complex subunit 15, Integrator complex subunit 5, Integrator complex subunit 8
Authors:Razew, M, Galej, W.P.
Deposit date:2024-03-17
Release date:2024-06-12
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structural basis of the Integrator complex assembly and association with transcription factors.
Mol.Cell, 84, 2024
8YK2
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BU of 8yk2 by Molmil
Blood group B alpha-1,3-galactosidase AgaBb from Bifidobacterium bifidum, construct T7-tag_24-700
Descriptor: Alpha-galactosidase, GLYCEROL, SODIUM ION, ...
Authors:Kashima, T, Akama, M, Ashida, H, Fushinobu, S.
Deposit date:2024-03-04
Release date:2024-07-10
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Crystal Structure of Bifidobacterium bifidum Glycoside Hydrolase Family 110 alpha-Galactosidase Specific for Blood Group B Antigen
J.Appl.Glyosci., 2024
9EWQ
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BU of 9ewq by Molmil
Influenza virus neuraminidase N1 NC13 ectodomain with a tetrabrachio-domain stalk
Descriptor: Neuraminidase
Authors:Roelofs, M.C, Zeev-Ben-Mordehai, T.
Deposit date:2024-04-04
Release date:2024-04-24
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Nanoparticle display of neuraminidase elicits enhanced antibody responses and protection against influenza A virus challenge.
Npj Vaccines, 9, 2024
9B12
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BU of 9b12 by Molmil
Structure of Optineurin bound to HOIP NZF1 domain and M1-linked diubiquitin, crystal form 1
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CHLORIDE ION, E3 ubiquitin-protein ligase RNF31, ...
Authors:Michel, M.A, Scutts, S, Komander, D.
Deposit date:2024-03-12
Release date:2024-07-31
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Linkage and substrate specificity conferred by NZF ubiquitin binding domains
To Be Published
9EP1
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BU of 9ep1 by Molmil
Structure of the Integrator arm module containing INTS10/13/14/15 subunits (state 2)
Descriptor: Integrator complex subunit 10, Integrator complex subunit 13, Integrator complex subunit 14, ...
Authors:Razew, M, Galej, W.P.
Deposit date:2024-03-16
Release date:2024-06-12
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Structural basis of the Integrator complex assembly and association with transcription factors.
Mol.Cell, 84, 2024
8XOM
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BU of 8xom by Molmil
Cryo-EM structure of human ABCC4 in complex with ANP-bound in NBD1 and METHOTREXATE
Descriptor: 2-[2-[(1~{S},2~{S},4~{S},5'~{R},6~{R},7~{S},8~{R},9~{S},12~{S},13~{R},16~{S})-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icos-18-ene-6,2'-oxane]-16-yl]oxyethyl]propane-1,3-diol, ATP-binding cassette sub-family C member 4, MAGNESIUM ION, ...
Authors:Zhang, P.F, Liu, Z.
Deposit date:2024-01-01
Release date:2024-07-17
Method:ELECTRON MICROSCOPY (3.05 Å)
Cite:The ATP-bound inward-open conformation of ABCC4 reveals asymmetric ATP binding for substrate transport.
Febs Lett., 2024
8XKC
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BU of 8xkc by Molmil
The structure of HLA-A/Pep16
Descriptor: Beta-2-microglobulin, HLA class I heavy chain, Spike protein S1
Authors:Zhang, J.N, Yue, C, Liu, J.
Deposit date:2023-12-23
Release date:2024-07-10
Method:X-RAY DIFFRACTION (2.18 Å)
Cite:Uncommon P1 Anchor-featured Viral T Cell Epitope Preference within HLA-A*2601 and HLA-A*0101 Individuals.
Immunohorizons, 8, 2024
9FA7
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BU of 9fa7 by Molmil
Structure of the Integrator arm module containing subunits INTS10/13/14/15 (state 3)
Descriptor: Integrator complex subunit 10, Integrator complex subunit 13, Integrator complex subunit 14, ...
Authors:Razew, M, Galej, W.P.
Deposit date:2024-05-10
Release date:2024-06-12
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Structural basis of the Integrator complex assembly and association with transcription factors.
Mol.Cell, 84, 2024
8Y2S
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BU of 8y2s by Molmil
P-hydroxybenzoate hydroxylase complexed with 4-hydroxy-3-methylbenzoic acid
Descriptor: 3-methyl-4-oxidanyl-benzoic acid, 4-hydroxybenzoate 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE
Authors:Hara, K, Hashimoto, H, Matsushita, T, Kishimoto, S, Watanabe, K.
Deposit date:2024-01-27
Release date:2024-05-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Functional Enhancement of Flavin-Containing Monooxygenase through Machine Learning Methodology
Acs Catalysis, 14, 2024
9EPZ
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BU of 9epz by Molmil
Crystal structure of human Casein Kinase II subunit alpha (CK2a1) in complex with allosteric ligand FGC3337
Descriptor: 1,2-ETHANEDIOL, Casein kinase II subunit alpha, SULFATE ION, ...
Authors:Kraemer, A, Greco, F, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2024-03-20
Release date:2024-05-01
Last modified:2024-08-07
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Synthesis and evaluation of chemical linchpins for highly selective CK2 alpha targeting.
Eur.J.Med.Chem., 276, 2024
9BHS
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BU of 9bhs by Molmil
Crystal structure of the WDR domain of human DCAF1 in complex with OICR-9939 compound
Descriptor: (4P)-N-[(1S)-3-amino-1-(3-chloro-4-fluorophenyl)-3-oxopropyl]-4-(4-chloro-2-fluorophenyl)-5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrole-3-carboxamide, DDB1- and CUL4-associated factor 1, UNKNOWN LIGAND
Authors:kimani, S, Dong, A, Li, Y, Seitova, A, Al-Awar, R, Wilson, B, Ackloo, S, Arrowsmith, C.H, Edwards, A.M, Halabelian, L, Structural Genomics Consortium (SGC)
Deposit date:2024-04-21
Release date:2024-05-01
Method:X-RAY DIFFRACTION (1.43 Å)
Cite:Crystal structure of the WDR domain of human DCAF1 in complex with OICR-9939 compound
To be published
9FA4
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BU of 9fa4 by Molmil
Structure of the Integrator arm module containing subunits INTS10/13/14/15 (state 1)
Descriptor: Integrator complex subunit 10, Integrator complex subunit 13, Integrator complex subunit 14, ...
Authors:Razew, M, Galej, W.P.
Deposit date:2024-05-10
Release date:2024-06-12
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Structural basis of the Integrator complex assembly and association with transcription factors.
Mol.Cell, 84, 2024

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PDB entries from 2024-08-14

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