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7MIY
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BU of 7miy by Molmil
Human N-type voltage-gated calcium channel Cav2.2 at 3.1 Angstrom resolution
Descriptor: 1,2-Distearoyl-sn-glycerophosphoethanolamine, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Yan, N, Gao, S, Yao, X.
Deposit date:2021-04-18
Release date:2021-07-07
Last modified:2021-08-18
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Structure of human Ca v 2.2 channel blocked by the painkiller ziconotide.
Nature, 596, 2021
8AQY
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BU of 8aqy by Molmil
streptavidin mutant S112A with an iridium catalyst for CH activation
Descriptor: Streptavidin, tert-butyl 7'-[5-[(3aS,4S,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-1-chloranyl-2,3,4,5,6-pentamethyl-spiro[1$l^{8}-iridapentacyclo[2.2.0.0^{1,3}.0^{1,5}.0^{2,6}]hexane-1,2'-3-aza-1-azonia-2$l^{8}-iridatricyclo[6.3.1.0^{4,12}]dodeca-1(11),4,6,8(12),9-pentaene]-3'-carboxylate
Authors:Igareta, N.V, Ward, T.R.
Deposit date:2022-08-15
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:streptavidin mutant S112A with an iridium catalyst for CH activation
To Be Published
8AJZ
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BU of 8ajz by Molmil
Serial femtosecond crystallography structure of CO bound ba3- type cytochrome c oxidase at 2 milliseconds after irradiation by a 532 nm laser
Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, CARBON MONOXIDE, COPPER (II) ION, ...
Authors:Safari, C, Ghosh, S, Andersson, R, Johannesson, J, Donoso, A.V, Bath, P, Bosman, R, Dahl, P, Nango, E, Tanaka, R, Zoric, D, Svensson, E, Nakane, T, Iwata, S, Neutze, R, Branden, G.
Deposit date:2022-07-29
Release date:2023-08-16
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Time-resolved serial crystallography to track the dynamics of carbon monoxide in the active site of cytochrome c oxidase.
Sci Adv, 9, 2023
8AKA
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BU of 8aka by Molmil
Human Sirt6 in complex with ADP-ribose and fragment cis-resveratrol
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:You, W, Steegborn, C.
Deposit date:2022-07-29
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Development of novel Sirtuin 6 inhibitors and activators based on a protein crystallography-based fragment screen
To Be Published
8AKE
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BU of 8ake by Molmil
Human Sirt6 in complex with ADP-ribose and fragment nicotinamide
Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, NAD-dependent protein deacetylase sirtuin-6, ...
Authors:You, W, Steegborn, C.
Deposit date:2022-07-29
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Development of novel Sirtuin 6 inhibitors and activators based on a protein crystallography-based fragment screen
To Be Published
8AM5
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BU of 8am5 by Molmil
RCII/PSI complex, class 3
Descriptor: (1R,2S)-4-{(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4S)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl}-2,5,5-trimethylcyclohex-3-en-1-ol, (3'R)-3'-hydroxy-beta,beta-caroten-4-one, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, ...
Authors:Zhao, Z, Vercellino, I, Knoppova, J, Sobotka, R, Murray, J.W, Nixon, P.J, Sazanov, L.A, Komenda, J.
Deposit date:2022-08-02
Release date:2023-08-16
Last modified:2024-10-09
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:The Ycf48 accessory factor occupies the site of the oxygen-evolving manganese cluster during photosystem II biogenesis.
Nat Commun, 14, 2023
8AK8
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BU of 8ak8 by Molmil
Human Sirt6 in complex with ADP-ribose and fragment 4-hydroxybenzamide
Descriptor: 4-HYDROXYBENZAMIDE, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:You, W, Steegborn, C.
Deposit date:2022-07-29
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Development of novel Sirtuin 6 inhibitors and activators based on a protein crystallography-based fragment screen
To Be Published
8AKG
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BU of 8akg by Molmil
Human Sirt6 in complex with ADP-ribose and fragment 4-amino-6-chlorobenzene-1,3-disulfonamide
Descriptor: 1,2-ETHANEDIOL, 4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDE, CHLORIDE ION, ...
Authors:You, W, Steegborn, C.
Deposit date:2022-07-29
Release date:2023-08-16
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Development of novel Sirtuin 6 inhibitors and activators based on a protein crystallography-based fragment screen
To Be Published
7MR1
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BU of 7mr1 by Molmil
Cryo-EM structure of RecBCD with undocked RecBNuc and flexible RecD C-terminus
Descriptor: RecBCD enzyme subunit RecB, RecBCD enzyme subunit RecC, RecBCD enzyme subunit RecD
Authors:Hao, L, Zhang, R, Lohman, T.M.
Deposit date:2021-05-07
Release date:2021-07-28
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Heterogeneity in E. coli RecBCD Helicase-DNA Binding and Base Pair Melting.
J.Mol.Biol., 433, 2021
3TLV
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BU of 3tlv by Molmil
The GLIC pentameric Ligand-Gated Ion Channel Loop2-22' oxidized mutant in a locally-closed conformation (LC3 subtype)
Descriptor: CHLORIDE ION, DODECYL-BETA-D-MALTOSIDE, Glr4197 protein
Authors:Sauguet, L, Nury, H, Corringer, P.J, Delarue, M.
Deposit date:2011-08-30
Release date:2012-05-16
Last modified:2012-06-27
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:A locally closed conformation of a bacterial pentameric proton-gated ion channel.
Nat.Struct.Mol.Biol., 19, 2012
7MR0
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BU of 7mr0 by Molmil
Cryo-EM structure of RecBCD with docked RecBNuc and flexible RecD
Descriptor: RecBCD enzyme subunit RecB, RecBCD enzyme subunit RecC, RecBCD enzyme subunit RecD
Authors:Hao, L, Zhang, R, Lohman, T.M.
Deposit date:2021-05-07
Release date:2021-07-28
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Heterogeneity in E. coli RecBCD Helicase-DNA Binding and Base Pair Melting.
J.Mol.Biol., 433, 2021
7MR2
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BU of 7mr2 by Molmil
Cryo-EM structure of RecBCD with undocked RecBNuc and flexible RecD
Descriptor: RecBCD enzyme subunit RecB, RecBCD enzyme subunit RecC, RecBCD enzyme subunit RecD
Authors:Hao, L, Zhang, R, Lohman, T.M.
Deposit date:2021-05-07
Release date:2021-07-28
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (4.3 Å)
Cite:Heterogeneity in E. coli RecBCD Helicase-DNA Binding and Base Pair Melting.
J.Mol.Biol., 433, 2021
7MR3
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BU of 7mr3 by Molmil
Cryo-EM structure of RecBCD-DNA complex with docked RecBNuc and stabilized RecD
Descriptor: DNA (60-MER), RecBCD enzyme subunit RecB, RecBCD enzyme subunit RecC, ...
Authors:Hao, L, Zhang, R, Lohman, T.M.
Deposit date:2021-05-07
Release date:2021-07-28
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Heterogeneity in E. coli RecBCD Helicase-DNA Binding and Base Pair Melting.
J.Mol.Biol., 433, 2021
7MR4
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BU of 7mr4 by Molmil
Cryo-EM structure of RecBCD-DNA complex with undocked RecBNuc and flexible RecD
Descriptor: DNA (60-MER), RecBCD enzyme subunit RecB, RecBCD enzyme subunit RecC, ...
Authors:Hao, L, Zhang, R, Lohman, T.M.
Deposit date:2021-05-07
Release date:2021-07-28
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (4.5 Å)
Cite:Heterogeneity in E. coli RecBCD Helicase-DNA Binding and Base Pair Melting.
J.Mol.Biol., 433, 2021
8B0Z
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BU of 8b0z by Molmil
Galectin-1 in Complex with Ligand JM171
Descriptor: BETA-MERCAPTOETHANOL, Galectin-1, SULFATE ION, ...
Authors:Grimm, C, Mut, J, Seibel, J.
Deposit date:2022-09-08
Release date:2023-09-20
Method:X-RAY DIFFRACTION (1.23 Å)
Cite:Galectin-1 in Complex with Ligand JM171
To Be Published
3TU5
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BU of 3tu5 by Molmil
Actin complex with Gelsolin Segment 1 fused to Cobl segment
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, ADENOSINE-5'-TRIPHOSPHATE, Actin, ...
Authors:Kudryashov, D.S, Sawaya, M.R, Durer, Z.A.O.
Deposit date:2011-09-15
Release date:2012-09-26
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structural States and dynamics of the d-loop in actin.
Biophys.J., 103, 2012
7MDY
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BU of 7mdy by Molmil
LolCDE nucleotide-bound
Descriptor: ADP ORTHOVANADATE, Lipo-releasing system transmembrane protein lolC, Lipoprotein transporter subunit LolE, ...
Authors:Sharma, S, Liao, M.
Deposit date:2021-04-06
Release date:2021-08-11
Last modified:2024-05-29
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Mechanism of LolCDE as a molecular extruder of bacterial triacylated lipoproteins
Nat Commun, 12, 2021
7MDX
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BU of 7mdx by Molmil
LolCDE nucleotide-free
Descriptor: (2R)-2-(tridecanoyloxy)propyl hexadecanoate, Lipoprotein-releasing system ATP-binding protein LolD, Lipoprotein-releasing system transmembrane protein LolC, ...
Authors:Sharma, S, Liao, M.
Deposit date:2021-04-06
Release date:2021-08-11
Last modified:2024-04-17
Method:ELECTRON MICROSCOPY (3.8 Å)
Cite:Mechanism of LolCDE as a molecular extruder of bacterial triacylated lipoproteins
Nat Commun, 12, 2021
3TYM
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BU of 3tym by Molmil
Structure of neuronal nitric oxide synthase heme domain in complex with 6-(((3S,4S)-4-(2-((2-methoxybenzyl)amino)ethoxy)pyrrolidin-3-yl)methyl)-4-methylpyridin-2-amine
Descriptor: 5,6,7,8-TETRAHYDROBIOPTERIN, 6-{[(3S,4S)-4-{2-[(2-methoxybenzyl)amino]ethoxy}pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine, ACETATE ION, ...
Authors:Li, H, Poulos, T.L.
Deposit date:2011-09-26
Release date:2012-03-14
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Intramolecular hydrogen bonding: A potential strategy for more bioavailable inhibitors of neuronal nitric oxide synthase.
Bioorg.Med.Chem., 20, 2012
8B0W
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BU of 8b0w by Molmil
Galectin-1 in Complex with Ligand MG49
Descriptor: BETA-MERCAPTOETHANOL, Galectin-1, SULFATE ION, ...
Authors:Grimm, C, Mut, J, Seibel, J.
Deposit date:2022-09-08
Release date:2023-09-20
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:Galectin-1 in Complex with Ligand MG49
To Be Published
7M6L
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BU of 7m6l by Molmil
High resolution structure of the membrane embedded skeletal muscle ryanodine receptor
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CAFFEINE, CALCIUM ION, ...
Authors:Melville, Z, Kim, K, Clarke, O.B, Marks, A.R.
Deposit date:2021-03-25
Release date:2021-08-18
Last modified:2022-01-19
Method:ELECTRON MICROSCOPY (3.98 Å)
Cite:High-resolution structure of the membrane-embedded skeletal muscle ryanodine receptor.
Structure, 30, 2022
8AB5
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BU of 8ab5 by Molmil
Structure of E. coli GlpG in complex with peptide derived inhibitor Ac-VRHA-conh-[4-(4-butyl)-phenoxy-1-phenyl-2-butyl]
Descriptor: Ac-VRHA-conh-[4-(4-butyl)-phenoxy-1-phenyl-2-butyl], Rhomboid protease GlpG
Authors:Skerlova, J, Polovinkin, V, Bach, K, Borshchevskiy, V, Strisovsky, K.
Deposit date:2022-07-04
Release date:2023-10-25
Last modified:2024-07-10
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Extensive targeting of chemical space at the prime side of ketoamide inhibitors of rhomboid proteases by branched substituents empowers their selectivity and potency.
Eur.J.Med.Chem., 275, 2024
7M6A
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BU of 7m6a by Molmil
High resolution structure of the membrane embedded skeletal muscle ryanodine receptor
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CAFFEINE, CALCIUM ION, ...
Authors:Melville, Z, Kim, K, Clarke, O.B, Marks, A.R.
Deposit date:2021-03-25
Release date:2021-09-08
Last modified:2022-01-19
Method:ELECTRON MICROSCOPY (3.36 Å)
Cite:High-resolution structure of the membrane-embedded skeletal muscle ryanodine receptor.
Structure, 30, 2022
7M1P
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BU of 7m1p by Molmil
Human ABCA4 structure in the unbound state
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Retinal-specific phospholipid-transporting ATPase ABCA4, ...
Authors:Scortecci, J.F, Van Petegem, F, Molday, R.S.
Deposit date:2021-03-14
Release date:2021-09-08
Last modified:2021-10-20
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Cryo-EM structures of the ABCA4 importer reveal mechanisms underlying substrate binding and Stargardt disease.
Nat Commun, 12, 2021
7M1Q
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BU of 7m1q by Molmil
Human ABCA4 structure in complex with N-ret-PE
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, MAGNESIUM ION, Retinal-specific phospholipid-transporting ATPase ABCA4, ...
Authors:Scortecci, J.F, Van Petegem, F, Molday, R.S.
Deposit date:2021-03-14
Release date:2021-09-08
Last modified:2021-10-20
Method:ELECTRON MICROSCOPY (2.92 Å)
Cite:Cryo-EM structures of the ABCA4 importer reveal mechanisms underlying substrate binding and Stargardt disease.
Nat Commun, 12, 2021

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