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4ID8
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BU of 4id8 by Molmil
The crystal structure of a [3Fe-4S] ferredoxin associated with CYP194A4 from R. palustris HaA2
Descriptor: FE3-S4 CLUSTER, Putative ferredoxin
Authors:Zhou, W.H, Zhang, T, Zhang, A.L, Bell, S.G, Wong, L.-L.
Deposit date:2012-12-11
Release date:2013-12-11
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:The structure of a novel electron-transfer ferredoxin from Rhodopseudomonas palustris HaA2 which contains a histidine residue in its iron-sulfur cluster-binding motif.
Acta Crystallogr.,Sect.D, 70, 2014
4OV1
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BU of 4ov1 by Molmil
The crystal structure of a novel electron transfer ferredoxin from R. palustris HaA2
Descriptor: FE3-S4 CLUSTER, Putative ferredoxin
Authors:Zhouw, W.H, Zhang, T, Zhang, A.L, Bell, S.G, Wong, L.-L.
Deposit date:2014-02-19
Release date:2014-05-21
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.306 Å)
Cite:The structure of a novel electron-transfer ferredoxin from Rhodopseudomonas palustris HaA2 which contains a histidine residue in its iron-sulfur cluster-binding motif.
Acta Crystallogr.,Sect.D, 70, 2014
5FBK
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BU of 5fbk by Molmil
Crystal structure of the extracellular domain of human calcium sensing receptor
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, BICARBONATE ION, CHLORIDE ION, ...
Authors:Zhang, T, Zhang, C, Miller, C.L, Zou, J, Moremen, K.W, Brown, E.M, Yang, J.J, Hu, J.
Deposit date:2015-12-14
Release date:2016-06-22
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural basis for regulation of human calcium-sensing receptor by magnesium ions and an unexpected tryptophan derivative co-agonist.
Sci Adv, 2, 2016
5FBH
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BU of 5fbh by Molmil
Crystal structure of the extracellular domain of human calcium sensing receptor with bound Gd3+
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, BICARBONATE ION, CHLORIDE ION, ...
Authors:Zhang, T, Zhang, C, Miller, C.L, Zou, J, Moremen, K.W, Brown, E.M, Yang, J.J, Hu, J.
Deposit date:2015-12-14
Release date:2016-06-22
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structural basis for regulation of human calcium-sensing receptor by magnesium ions and an unexpected tryptophan derivative co-agonist.
Sci Adv, 2, 2016
9IRM
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BU of 9irm by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZG283
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (6S,9aS)-8-(anthracen-9-ylmethyl)-6-[(2S)-butan-2-yl]-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit
Authors:Wei, B.Y, Wang, P.Y, Zhang, T, Yang, C.-G.
Deposit date:2024-07-16
Release date:2024-10-23
Last modified:2025-02-19
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Structure-guided development of selective caseinolytic protease P agonists as antistaphylococcal agents.
Cell Rep Med, 5, 2024
9IRP
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BU of 9irp by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZG297
Descriptor: (6S,9aS)-6-[(2S)-butan-2-yl]-4,7-bis(oxidanylidene)-8-(phenanthren-9-ylmethyl)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, MAGNESIUM ION
Authors:Wei, B.Y, Wang, P.Y, Zhang, T, Yang, C.-G.
Deposit date:2024-07-16
Release date:2024-10-23
Last modified:2025-02-19
Method:X-RAY DIFFRACTION (1.901 Å)
Cite:Structure-guided development of selective caseinolytic protease P agonists as antistaphylococcal agents.
Cell Rep Med, 5, 2024
5GS9
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BU of 5gs9 by Molmil
Crystal structure of CASTOR1-arginine
Descriptor: ARGININE, GATS-like protein 3
Authors:Zhang, T, Ding, J.
Deposit date:2016-08-15
Release date:2016-09-28
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural insight into the arginine-binding specificity of CASTOR1 in amino acid-dependent mTORC1 signaling.
Cell Discov, 2, 2016
9K2C
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BU of 9k2c by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZY1
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (6~{S},9~{a}~{S})-6-(1~{H}-imidazol-5-ylmethyl)-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-~{N}-(phenylmethyl)-3,6,9,9~{a}-tetrahydro-2~{H}-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, ...
Authors:Li, J.H, Wu, W, Zhang, T, Yang, C.-G.
Deposit date:2024-10-17
Release date:2025-02-19
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Structure-Guided Development of ClpP Agonists with Potent Therapeutic Activities against Staphylococcus aureus Infection.
J.Med.Chem., 68, 2025
9K2K
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BU of 9k2k by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZY7
Descriptor: (6~{S},9~{a}~{S})-6-(2-methylpropyl)-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-~{N}-(phenylmethyl)-3,6,9,9~{a}-tetrahydro-2~{H}-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit
Authors:Li, J.H, Wu, W, Zhang, T, Yang, C.-G.
Deposit date:2024-10-17
Release date:2025-02-19
Method:X-RAY DIFFRACTION (2.74 Å)
Cite:Structure-Guided Development of ClpP Agonists with Potent Therapeutic Activities against Staphylococcus aureus Infection.
J.Med.Chem., 68, 2025
9K2A
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BU of 9k2a by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZY27
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (6~{S},9~{a}~{S})-6-(3-azidopropyl)-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-~{N}-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9~{a}-tetrahydro-2~{H}-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, ...
Authors:Wei, B.Y, Wang, P.Y, Wu, W, Zhang, T, Yang, C.-G.
Deposit date:2024-10-17
Release date:2025-02-19
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Structure-Guided Development of ClpP Agonists with Potent Therapeutic Activities against Staphylococcus aureus Infection.
J.Med.Chem., 68, 2025
9K2D
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BU of 9k2d by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZY39
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (6~{S},9~{a}~{S})-6-[(2~{S})-butan-2-yl]-8-[(4-methoxynaphthalen-1-yl)methyl]-4,7-bis(oxidanylidene)-~{N}-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9~{a}-tetrahydro-2~{H}-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit
Authors:Wei, B.Y, Wang, P.Y, Wu, W, Zhang, T, Yang, C.-G.
Deposit date:2024-10-17
Release date:2025-02-19
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Structure-Guided Development of ClpP Agonists with Potent Therapeutic Activities against Staphylococcus aureus Infection.
J.Med.Chem., 68, 2025
9K2B
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BU of 9k2b by Molmil
Structure of ClpP from Staphylococcus aureus in complex with ZY18
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, (6~{S},9~{a}~{S})-6-[(2~{S})-butan-2-yl]-~{N}-[(2~{S})-2-methylbutyl]-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-3,6,9,9~{a}-tetrahydro-2~{H}-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, ...
Authors:Wei, B.Y, Wang, P.Y, Wu, W, Zhang, T, Yang, C.-G.
Deposit date:2024-10-17
Release date:2025-02-19
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Structure-Guided Development of ClpP Agonists with Potent Therapeutic Activities against Staphylococcus aureus Infection.
J.Med.Chem., 68, 2025
8TSR
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BU of 8tsr by Molmil
Open, inward-facing MsbA structure (OIF4)
Descriptor: ATP-binding transport protein MsbA
Authors:Yang, B, Zhang, T, Lyu, J, Laganowsky, A.D, Zhao, M.
Deposit date:2023-08-11
Release date:2024-06-19
Last modified:2025-06-04
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Native mass spectrometry and structural studies reveal modulation of MsbA-nucleotide interactions by lipids.
Nat Commun, 15, 2024
8TSO
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BU of 8tso by Molmil
KDL bound, nucleotide-free MsbA in open, outward-facing conformation
Descriptor: (2~{R},4~{R},5~{R},6~{R})-6-[(1~{R})-1,2-bis(oxidanyl)ethyl]-2-[(2~{R},4~{R},5~{R},6~{R})-6-[(1~{R})-1,2-bis(oxidanyl)ethyl]-2-carboxy-2-[[(2~{R},3~{S},4~{R},5~{R},6~{R})-5-[[(3~{R})-3-dodecanoyloxytetradecanoyl]amino]-6-[[(2~{R},3~{S},4~{R},5~{R},6~{R})-3-oxidanyl-5-[[(3~{R})-3-oxidanyltetradecanoyl]amino]-4-[(3~{R})-3-oxidanyltetradecanoyl]oxy-6-phosphonooxy-oxan-2-yl]methoxy]-3-phosphonooxy-4-[(3~{R})-3-tetradecanoyloxytetradecanoyl]oxy-oxan-2-yl]methoxy]-5-oxidanyl-oxan-4-yl]oxy-4,5-bis(oxidanyl)oxane-2-carboxylic acid, ATP-binding transport protein MsbA, PENTAETHYLENE GLYCOL MONODECYL ETHER
Authors:Yang, B, Zhang, T, Lyu, J, Laganowsky, A.D, Zhao, M.
Deposit date:2023-08-11
Release date:2024-06-19
Last modified:2025-05-14
Method:ELECTRON MICROSCOPY (2.68 Å)
Cite:Native mass spectrometry and structural studies reveal modulation of MsbA-nucleotide interactions by lipids.
Nat Commun, 15, 2024
8TSP
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BU of 8tsp by Molmil
Open, inward-facing MsbA structure (OIF1)
Descriptor: ATP-binding transport protein MsbA
Authors:Yang, B, Zhang, T, Lyu, J, Laganowsky, A.D, Zhao, M.
Deposit date:2023-08-11
Release date:2024-06-19
Last modified:2025-05-14
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Native mass spectrometry and structural studies reveal modulation of MsbA-nucleotide interactions by lipids.
Nat Commun, 15, 2024
8TSQ
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BU of 8tsq by Molmil
Open, inward-facing MsbA structure (OIF2)
Descriptor: ATP-binding transport protein MsbA
Authors:Yang, B, Zhang, T, Lyu, J, Laganowsky, A.D, Zhao, M.
Deposit date:2023-08-11
Release date:2024-06-19
Last modified:2025-06-04
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Native mass spectrometry and structural studies reveal modulation of MsbA-nucleotide interactions by lipids.
Nat Commun, 15, 2024
8TSS
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BU of 8tss by Molmil
Open, inward-facing MsbA structure (OIF3)
Descriptor: ATP-binding transport protein MsbA
Authors:Yang, B, Zhang, T, Lyu, J, Laganowsky, A.D, Zhao, M.
Deposit date:2023-08-11
Release date:2024-06-19
Last modified:2025-05-21
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Native mass spectrometry and structural studies reveal modulation of MsbA-nucleotide interactions by lipids.
Nat Commun, 15, 2024
8J1M
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BU of 8j1m by Molmil
Crystal structure of a crosslinked variant of BbZIP
Descriptor: CADMIUM ION, CHLORIDE ION, MERCURY (II) ION, ...
Authors:Zhang, T, Zhang, Y, Sui, D, Hu, J.
Deposit date:2023-04-13
Release date:2024-11-13
Method:X-RAY DIFFRACTION (1.952 Å)
Cite:Molecular insights into substrate translocation in an elevator-type metal transporter.
Biorxiv, 2024
8W94
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BU of 8w94 by Molmil
Azumapecten Farreri homopolymeric ferritin (ApF) mutant-H2KE exposed to H2O2 for 2 s
Descriptor: FE (III) ION, Ferritin, HYDROGEN PEROXIDE
Authors:Zhang, T, Jiao, R.
Deposit date:2023-09-04
Release date:2024-09-11
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural Insights into the Reaction between Hydrogen Peroxide and Di-iron Complexes at the Ferroxidase Center of Ferritin.
Inorg.Chem., 63, 2024
8W91
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BU of 8w91 by Molmil
Azumapecten Farreri homopolymeric ferritin mutant - H2KE exposed to H2O2 for 3 min
Descriptor: FE (III) ION, Ferritin
Authors:Zhang, T, Jiao, R.
Deposit date:2023-09-04
Release date:2024-09-11
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Structural Insights into the Reaction between Hydrogen Peroxide and Di-iron Complexes at the Ferroxidase Center of Ferritin.
Inorg.Chem., 63, 2024
8W93
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BU of 8w93 by Molmil
Azumapecten Farreri homopolymeric ferritin (ApF) mutant-H2KE
Descriptor: FE (III) ION, Ferritin
Authors:Zhang, T, Jiao, R.
Deposit date:2023-09-04
Release date:2024-09-11
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Structural Insights into the Reaction between Hydrogen Peroxide and Di-iron Complexes at the Ferroxidase Center of Ferritin.
Inorg.Chem., 63, 2024
8W95
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BU of 8w95 by Molmil
Azumapecten Farreri homopolymeric ferritin (ApF) mutant-H2KE exposed to H2O2 for 20 s
Descriptor: FE (III) ION, Ferritin, OXYGEN MOLECULE
Authors:Zhang, T, Jiao, R.
Deposit date:2023-09-04
Release date:2024-09-11
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Structural Insights into the Reaction between Hydrogen Peroxide and Di-iron Complexes at the Ferroxidase Center of Ferritin.
Inorg.Chem., 63, 2024
8W92
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BU of 8w92 by Molmil
human H ferritin with 2 Fe(II)/subunit loading
Descriptor: CALCIUM ION, FE (III) ION, Ferritin heavy chain
Authors:Zhang, T, Jiao, R.
Deposit date:2023-09-04
Release date:2024-09-11
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Structural Insights into the Reaction between Hydrogen Peroxide and Di-iron Complexes at the Ferroxidase Center of Ferritin.
Inorg.Chem., 63, 2024
7VKK
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BU of 7vkk by Molmil
Crystal structure of D. melanogaster SAMTOR V66W/E67P mutant
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, S-adenosylmethionine sensor upstream of mTORC1, SULFATE ION
Authors:Zhang, T, Ding, J.
Deposit date:2021-09-30
Release date:2022-07-20
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3.55 Å)
Cite:Molecular mechanism of S -adenosylmethionine sensing by SAMTOR in mTORC1 signaling.
Sci Adv, 8, 2022
7EU8
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BU of 7eu8 by Molmil
Structure of the human GluN1-GluN2B NMDA receptor in complex with S-ketamine,glycine and glutamate
Descriptor: (2~{S})-2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one, 2-acetamido-2-deoxy-beta-D-glucopyranose, Glutamate receptor ionotropic, ...
Authors:Zhang, T, Zhang, Y, Zhu, S.
Deposit date:2021-05-16
Release date:2021-07-28
Last modified:2024-11-06
Method:ELECTRON MICROSCOPY (4.07 Å)
Cite:Structural basis of ketamine action on human NMDA receptors.
Nature, 596, 2021

238582

數據於2025-07-09公開中

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