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9QGF
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BU of 9qgf by Molmil
Crystal structure of an NADH-accepting ene reductase variant NostocER1-L1,5 mutant T354K
Descriptor: 1,2-ETHANEDIOL, 1-[(6~{R})-3,3-diethanoyl-6-methyl-cyclohexa-1,4-dien-1-yl]ethanone, All1865 protein, ...
Authors:Bischoff, D, Walla, B, Janowski, R, Maslakova, A, Niessing, D, Weuster-Botz, D.
Deposit date:2025-03-13
Release date:2025-04-02
Last modified:2025-05-14
Method:X-RAY DIFFRACTION (1.444 Å)
Cite:Rational Introduction of Electrostatic Interactions at Crystal Contacts to Enhance Protein Crystallization of an Ene Reductase.
Biomolecules, 15, 2025
9NFJ
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BU of 9nfj by Molmil
Tuna P-glycoprotein Apo Conformation 2
Descriptor: Permeability Glycoprotein (P-gp)
Authors:Young, M.A, Rees, S.D, Nicklisch, S.C.T, Stowell, M, Hamdoun, A, Chang, G.
Deposit date:2025-02-21
Release date:2025-06-04
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (3.98 Å)
Cite:Cryo-EM Structures of Apo and DDT-Bound P-Glycoprotein in Yellowfin Tuna.
Environ Sci Technol., 59, 2025
8WIZ
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BU of 8wiz by Molmil
cryo-EM structure of alligator haemoglobin in deoxy form
Descriptor: BICARBONATE ION, Hemoglobin subunit alpha, Hemoglobin subunit beta, ...
Authors:Takahashi, K, Lee, Y, Fago, A, Bautista, N.M, Kawamoto, A, Kurisu, G, Storz, J, Nishizawa, T, Tame, J.R.H.
Deposit date:2023-09-25
Release date:2024-08-14
Last modified:2025-03-05
Method:ELECTRON MICROSCOPY (2.2 Å)
Cite:The unique allosteric property of crocodilian haemoglobin elucidated by cryo-EM.
Nat Commun, 15, 2024
9QGC
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BU of 9qgc by Molmil
Crystal structure of an NADH-accepting ene reductase variant NostocER1-L1,5 mutant Q204K
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, All1865 protein, ...
Authors:Bischoff, D, Walla, B, Janowski, R, Maslakova, A, Niessing, D, Weuster-Botz, D.
Deposit date:2025-03-13
Release date:2025-04-02
Last modified:2025-05-14
Method:X-RAY DIFFRACTION (1.239 Å)
Cite:Rational Introduction of Electrostatic Interactions at Crystal Contacts to Enhance Protein Crystallization of an Ene Reductase.
Biomolecules, 15, 2025
9NDC
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BU of 9ndc by Molmil
[3,14,12-2] Shifted tensegrity triangle with an (arm,center,arm) distribution of (3,14,12) base pairs and 2 nt sticky ends
Descriptor: DNA (31-MER), DNA (5'-D(*TP*GP*CP*TP*CP*GP*TP*CP*AP*GP*TP*CP*GP*T)-3'), DNA (5'-D(P*CP*CP*AP*CP*GP*TP*GP*TP*GP*AP*GP*TP*CP*A)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-18
Release date:2025-06-11
Method:X-RAY DIFFRACTION (6.34 Å)
Cite:Shifted tensegrity triangles
To Be Published
9QI7
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BU of 9qi7 by Molmil
Crystal structure of I105R mutant of BlaC from Mycobacterium tuberculosis in complex with avibactam
Descriptor: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, ACETATE ION, Beta-lactamase, ...
Authors:Chikunova, A, Radojkovic, M, Ubbink, M.
Deposit date:2025-03-17
Release date:2025-06-11
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:High-resolution activity and inhibitor profiling of residue 105 in class A beta-lactamases
To Be Published
8WIY
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BU of 8wiy by Molmil
cryo-EM structure of alligator haemoglobin in oxy form
Descriptor: Hemoglobin subunit alpha, Hemoglobin subunit beta, OXYGEN MOLECULE, ...
Authors:Takahashi, K, Lee, Y, Fago, A, Bautista, N.M, Kawamoto, A, Kurisu, G, Storz, J, Nishizawa, T, Tame, J.R.H.
Deposit date:2023-09-25
Release date:2024-08-14
Last modified:2025-03-05
Method:ELECTRON MICROSCOPY (2.31 Å)
Cite:The unique allosteric property of crocodilian haemoglobin elucidated by cryo-EM.
Nat Commun, 15, 2024
9NLL
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BU of 9nll by Molmil
[0,7,13-->14] Shifted tensegrity triangle with an (arm,center,arm) distribution of (0,7,13) base pairs and 1 nt sticky ends containing a semi-junction that becomes left-handed
Descriptor: DNA (5'-D(*CP*TP*GP*TP*A)-3'), DNA (5'-D(*GP*TP*GP*CP*GP*TP*GP*TP*GP*AP*CP*TP*GP*T)-3'), DNA (5'-D(AP*CP*GP*GP*AP*CP*AP*GP*T*CP*AP*CP*AP*CP*GP*CP*A)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-03-03
Release date:2025-06-11
Method:X-RAY DIFFRACTION (6.73 Å)
Cite:Shifted tensegrity triangles
To Be Published
9N3H
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BU of 9n3h by Molmil
Crystal structure of HBV capsid with compound 18
Descriptor: Capsid protein, N-[3-(difluoromethyl)phenyl]-5-[{[(1s,4s)-4-hydroxycyclohexyl]amino}(oxo)acetyl]-1,2,4-trimethyl-1H-pyrrole-3-carboxamide
Authors:White, A, Lakshminarasimhan, D, Cakici, O, Suto, R.
Deposit date:2025-01-31
Release date:2025-07-02
Method:X-RAY DIFFRACTION (2.543 Å)
Cite:Discovery of VNRX-9945, a Potent, Broadly Active Capsid Assembly Modulator as a Clinical Candidate for the Treatment of Chronic Hepatitis B Virus Infection
Acs Med.Chem.Lett., 2025
9LBM
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BU of 9lbm by Molmil
Cryo-EM structure of bacteriophage phiXacJX1 capsid
Descriptor: major capsid protein gp3
Authors:Guo, M, Wang, A, Zheng, Y, Liu, C, Shao, Q, Fang, Q.
Deposit date:2025-01-03
Release date:2025-05-07
Last modified:2025-06-18
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Cryo-EM structures of a Xanthomonas phage: Insights into viral architecture and implications for the model phage HK97.
Structure, 33, 2025
9O0X
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BU of 9o0x by Molmil
Co-crystal structure of human TREX1 in complex with an inhibitor
Descriptor: 1,2-ETHANEDIOL, 5-({N-[(2,3-dichlorophenyl)methyl]-3,5-difluorobenzamido}methyl)-3-(methylamino)pyridine-2-carboxylic acid, MAGNESIUM ION, ...
Authors:Dehghani-Tafti, S, Dong, A, Li, Y, Ackloo, S, Arrowsmith, C.H, Edwards, A.M, Halabelian, L, Structural Genomics Consortium (SGC)
Deposit date:2025-04-03
Release date:2025-05-21
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Co-crystal structure of human TREX1 in complex with an inhibitor
To be published
9NFG
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BU of 9nfg by Molmil
[4,8,8-1] Shifted tensegrity triangle with an (arm,center,arm) distribution of (4,8,8) base pairs and 1 nt sticky ends
Descriptor: DNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*CP*GP*TP*CP*A)-3'), DNA (5'-D(P*C*TP*GP*AP*CP*GP*TP*GP*TP*GP*CP*TP*C)-3'), DNA (5'-D(P*CP*AP*CP*AP*CP*CP*GP*T)-3'), ...
Authors:Abi Rizk, J, Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-21
Release date:2025-04-09
Method:X-RAY DIFFRACTION (5.77 Å)
Cite:Shifted tensegrity triangles
To Be Published
9NDB
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BU of 9ndb by Molmil
[4,7,8-2] Shifted tensegrity triangle with an (arm,center,arm) distribution of (4,7,8) base pairs and 2 nt sticky ends
Descriptor: DNA (5'-D(*GP*AP*GP*CP*AP*CP*CP*TP*GP*TP*A)-3'), DNA (5'-D(*TP*CP*TP*GP*AP*CP*TP*GP*TP*GP*GP*TP*GP*C)-3'), DNA (5'-D(P*AP*CP*AP*CP*CP*GP*T)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-18
Release date:2025-04-09
Method:X-RAY DIFFRACTION (4.07 Å)
Cite:Shifted tensegrity triangles
To Be Published
9UE9
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BU of 9ue9 by Molmil
Heptameric pore structure of Vibrio cholerae Cytolysin (VCC) embedded in lipid bilayer
Descriptor: HlyA
Authors:Dutta, S, Chatterjee, A.
Deposit date:2025-04-08
Release date:2025-05-21
Last modified:2025-06-11
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Heptameric pore structure of Vibrio cholerae Cytolysin (VCC) embedded in lipid bilayer
To Be Published
9NDI
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BU of 9ndi by Molmil
[3,8,9,P-1] Shifted tensegrity triangle with an (arm,center,arm) distribution of (3,8,9) base pairs, 1 nt sticky ends, and 5' phosphates
Descriptor: DNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*GP*CP*GP*TP*CP*A)-3'), DNA (5'-D(P*CP*AP*CP*AP*CP*CP*GP*T)-3'), DNA (5'-D(P*CP*T*GP*AP*CP*GP*CP*TP*GP*TP*GP*CP*T)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-18
Release date:2025-04-09
Method:X-RAY DIFFRACTION (6.39 Å)
Cite:Shifted tensegrity triangles
To Be Published
9N1F
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BU of 9n1f by Molmil
Crystal Structure of the Ark2C-Ubc13~Ub-Mms2 complex
Descriptor: E3 ubiquitin-protein ligase ARK2C, Ubiquitin, Ubiquitin-conjugating enzyme E2 N, ...
Authors:Paluda, A, Middleton, A.J, Day, C.L.
Deposit date:2025-01-26
Release date:2025-06-11
Last modified:2025-06-25
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Arkadia and Ark2C Promote Substrate Ubiquitylation with Multiple E2 Enzymes.
J.Mol.Biol., 437, 2025
8WJ0
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BU of 8wj0 by Molmil
cryo-EM structure of human haemoglobin in carbonmonoxy form
Descriptor: CARBON MONOXIDE, Hemoglobin subunit alpha, Hemoglobin subunit beta, ...
Authors:Takahashi, K, Lee, Y, Fago, A, Bautista, N.M, Kawamoto, A, Kurisu, G, Storz, J, Nishizawa, T, Tame, J.R.H.
Deposit date:2023-09-25
Release date:2024-08-14
Last modified:2025-03-05
Method:ELECTRON MICROSCOPY (2.24 Å)
Cite:The unique allosteric property of crocodilian haemoglobin elucidated by cryo-EM.
Nat Commun, 15, 2024
9QGB
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BU of 9qgb by Molmil
Crystal structure of an NADH-accepting ene reductase variant NostocER1-L1,5 (engineered Loop Swap from Achromobacter sp. JA81)
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, All1865 protein, ...
Authors:Bischoff, D, Walla, B, Janowski, R, Maslakova, A, Maehler, C, Niessing, D, Weuster-Botz, D.
Deposit date:2025-03-13
Release date:2025-04-02
Last modified:2025-05-14
Method:X-RAY DIFFRACTION (1.27 Å)
Cite:Rational Introduction of Electrostatic Interactions at Crystal Contacts to Enhance Protein Crystallization of an Ene Reductase.
Biomolecules, 15, 2025
9LK5
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BU of 9lk5 by Molmil
The structure of Lhcb8-C2S2 PSII-LHCII supercomplex from Arabidopsis thaliana
Descriptor: (1R,3R)-6-{(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4R,6R)-4-HYDROXY-2,2,6-TRIMETHYL-7-OXABICYCLO[4.1.0]HEPT-1-YL]-3,7,12,16-TETRAMETHYLOCTADECA-1,3,5,7,9,11,13,15,17-NONAENYLIDENE}-1,5,5-TRIMETHYLCYCLOHEXANE-1,3-DIOL, (3R,3'R,6S)-4,5-DIDEHYDRO-5,6-DIHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, (3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-DIEPOXY-5,6,5',6'- TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, ...
Authors:Zhou, Q, Caferri, R, Shan, J.Y, Amelii, A, Bassi, R, Liu, Z.F.
Deposit date:2025-01-16
Release date:2025-06-18
Method:ELECTRON MICROSCOPY (3 Å)
Cite:A stress-induced paralog of Lhcb4 controls the photosystem II functional architecture in Arabidopsis thaliana
To Be Published
9NK5
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BU of 9nk5 by Molmil
[0,7,12-->14] Shifted tensegrity triangle with an (arm,center,arm) distribution of (0,7,12) base pairs and 2 nt sticky ends containing a semi-junction that becomes left-handed
Descriptor: DNA (5'-D(*GP*AP*AP*TP*GP*CP*GP*TP*AP*GP*CP*TP*GP*T)-3'), DNA (5'-D(*TP*CP*TP*GP*TP*AP*CP*GP*GP*AP*CP*AP*GP*C*TP*AP*CP*GP*CP*AP*T)-3'), DNA (5'-D(P*CP*CP*GP*TP*AP*CP*A)-3')
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-28
Release date:2025-06-11
Method:X-RAY DIFFRACTION (4.58 Å)
Cite:Shifted tensegrity triangles
To Be Published
9NDN
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BU of 9ndn by Molmil
[0,8,11,P-2] Shifted tensegrity triangle with an (arm,center,arm) distribution of (0,8,11) base pairs, 2 nt sticky ends, and 5' phosphates
Descriptor: DNA (5'-D(P*A*AP*GP*TP*G*CP*AP*CP*TP*CP*TP*GP*T)-3'), DNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*GP*AP*GP*TP*GP*CP*AP*C)-3'), DNA (5'-D(P*CP*AP*CP*AP*CP*CP*GP*T)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-18
Release date:2025-04-09
Method:X-RAY DIFFRACTION (6.41 Å)
Cite:Shifted tensegrity triangles
To Be Published
9QFU
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BU of 9qfu by Molmil
Human Tryptase beta-2 (hTPSB2) complexed with covalent inhibitor Compound #1
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Porta, A, Manelfi, C, Talarico, C, Beccari, A.R, Brindisi, M, Summa, V, Iaconis, D, Gobbi, M, Beeg, M.
Deposit date:2025-03-12
Release date:2025-03-26
Last modified:2025-04-09
Method:X-RAY DIFFRACTION (1.983 Å)
Cite:Integrating Surface Plasmon Resonance and Docking Analysis for Mechanistic Insights of Tryptase Inhibitors.
Molecules, 30, 2025
9O0W
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BU of 9o0w by Molmil
Co-crystal structure of human TREX1 in complex with an inhibitor
Descriptor: 1,2-ETHANEDIOL, 5-({N-[(2,3-dichlorophenyl)methyl]-3,5-difluorobenzamido}methyl)pyridine-2-carboxylic acid, MAGNESIUM ION, ...
Authors:Dehghani-Tafti, S, Dong, A, Li, Y, Ackloo, S, Arrowsmith, C.H, Edwards, A.M, Halabelian, L, Structural Genomics Consortium (SGC)
Deposit date:2025-04-03
Release date:2025-05-21
Method:X-RAY DIFFRACTION (1.43 Å)
Cite:Co-crystal structure of human TREX1 in complex with an inhibitor
To be published
9URH
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BU of 9urh by Molmil
Structural insight into DNA recognition by RRM1+2 domain of human ETR-3 protein
Descriptor: CUGBP Elav-like family member 2, DNA (5'-D(P*TP*GP*GP*TP*C)-3'), MAGNESIUM ION
Authors:Patra, A, Bhavesh, N.S.
Deposit date:2025-04-29
Release date:2025-05-28
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Structural insight into DNA recognition by RRM1+2 domain of human ETR-3 protein
To Be Published
9NC4
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BU of 9nc4 by Molmil
[2,8,9-2] Shifted tensegrity triangle with an (arm,center,arm) distribution of (2,8,9) base pairs and 2 nt sticky ends
Descriptor: DNA (5'-D(*GP*AP*GP*CP*TP*GP*TP*G)-3'), DNA (5'-D(*TP*CP*TP*GP*AP*CP*TP*CP*TP*GP*TP*GP*C)-3'), DNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*GP*AP*GP*TP*CP*A)-3'), ...
Authors:Horvath, A, Vecchioni, S, Woloszyn, K, Ohayon, Y.P, Sha, R.
Deposit date:2025-02-14
Release date:2025-04-09
Method:X-RAY DIFFRACTION (4.29 Å)
Cite:Shifted tensegrity triangles
To Be Published

238582

數據於2025-07-09公開中

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