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6P5S
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BU of 6p5s by Molmil
HIPK2 kinase domain bound to CX-4945
Descriptor: 5-[(3-chlorophenyl)amino]benzo[c][2,6]naphthyridine-8-carboxylic acid, Homeodomain-interacting protein kinase 2
Authors:Agnew, C, Liu, L, Jura, N.
Deposit date:2019-05-30
Release date:2019-07-31
Last modified:2019-09-25
Method:X-RAY DIFFRACTION (2.194 Å)
Cite:The crystal structure of the protein kinase HIPK2 reveals a unique architecture of its CMGC-insert region.
J.Biol.Chem., 294, 2019
6UNQ
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BU of 6unq by Molmil
Kinase domain of ALK2-K493A with AMPPNP
Descriptor: Activin receptor type-1, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
Authors:Agnew, C, Jura, N.
Deposit date:2019-10-13
Release date:2021-07-07
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural basis for ALK2/BMPR2 receptor complex signaling through kinase domain oligomerization.
Nat Commun, 12, 2021
6UNR
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BU of 6unr by Molmil
Kinase domain of ALK2-K492A/K493A with AMPPNP
Descriptor: Activin receptor type-1, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
Authors:Agnew, C, Jura, N.
Deposit date:2019-10-13
Release date:2021-07-07
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural basis for ALK2/BMPR2 receptor complex signaling through kinase domain oligomerization.
Nat Commun, 12, 2021
6UNP
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BU of 6unp by Molmil
Crystal structure of the kinase domain of BMPR2-D485G
Descriptor: 1,2-ETHANEDIOL, ADENOSINE-5'-DIPHOSPHATE, Bone morphogenetic protein receptor type-2, ...
Authors:Agnew, C, Jura, N.
Deposit date:2019-10-13
Release date:2021-07-07
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis for ALK2/BMPR2 receptor complex signaling through kinase domain oligomerization.
Nat Commun, 12, 2021
6UNS
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BU of 6uns by Molmil
Kinase domain of ALK2-K492A/K493A with LDN-193189
Descriptor: 4-[6-(4-piperazin-1-ylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]quinoline, Activin receptor type-1
Authors:Agnew, C, Jura, N.
Deposit date:2019-10-13
Release date:2021-07-07
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis for ALK2/BMPR2 receptor complex signaling through kinase domain oligomerization.
Nat Commun, 12, 2021
3NTN
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BU of 3ntn by Molmil
Crystal Structure of UspA1 head and neck domain from Moraxella catarrhalis
Descriptor: CHLORIDE ION, NICKEL (II) ION, SULFATE ION, ...
Authors:Conners, R, Zaccai, N, Agnew, C, Burton, N, Brady, R.L.
Deposit date:2010-07-05
Release date:2011-07-06
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Correlation of in situ mechanosensitive responses of the Moraxella catarrhalis adhesin UspA1 with fibronectin and receptor CEACAM1 binding.
Proc.Natl.Acad.Sci.USA, 108, 2011
6OP9
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BU of 6op9 by Molmil
HER3 pseudokinase domain bound to bosutinib
Descriptor: 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-3-carbonitrile, Receptor tyrosine-protein kinase erbB-3
Authors:Littlefield, P, Agnew, C, Jura, N.
Deposit date:2019-04-24
Release date:2019-08-21
Last modified:2022-02-16
Method:X-RAY DIFFRACTION (2.501 Å)
Cite:Targetable HER3 functions driving tumorigenic signaling in HER2-amplified cancers.
Cell Rep, 38, 2022
3R8Q
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BU of 3r8q by Molmil
Structure of Fibronectin domain 12-14
Descriptor: Fibronectin
Authors:Zaccai, N.R, Agnew, C, Brady, R.L.
Deposit date:2011-03-24
Release date:2012-04-11
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure of Fibronectin domain 12-14
To be Published
4KVT
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BU of 4kvt by Molmil
Crystal structure of a 6-helix coiled coil CC-Hex-L24C
Descriptor: 6-helix coiled coil CC-Hex-L24C peptide
Authors:Burton, A.J, Agnew, C, Brady, R.L, Woolfson, D.N.
Deposit date:2013-05-23
Release date:2013-08-21
Last modified:2013-09-11
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Accessibility, Reactivity, and Selectivity of Side Chains within a Channel of de Novo Peptide Assembly.
J.Am.Chem.Soc., 135, 2013
4KVV
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BU of 4kvv by Molmil
Crystal structure of an alkylated Cys mutant of CC-Hex
Descriptor: 6-HELIX COILED COIL CC-HEX-L24C PEPTIDE with an alkylated Cys mutation
Authors:Burton, A.J, Agnew, C, Brady, R.L, Woolfson, D.N.
Deposit date:2013-05-23
Release date:2013-08-21
Last modified:2013-09-11
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Accessibility, Reactivity, and Selectivity of Side Chains within a Channel of de Novo Peptide Assembly.
J.Am.Chem.Soc., 135, 2013
4KVU
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BU of 4kvu by Molmil
Crystal structure of a 6-helix coiled coil CC-Hex-L17C-W224BF
Descriptor: 6-helix coiled coil CC-Hex-L17C-W224BF, GLYCEROL
Authors:Burton, A.J, Agnew, C, Brady, R.L, Woolfson, D.N.
Deposit date:2013-05-23
Release date:2013-08-21
Last modified:2013-09-11
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Accessibility, Reactivity, and Selectivity of Side Chains within a Channel of de Novo Peptide Assembly.
J.Am.Chem.Soc., 135, 2013
6CNL
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BU of 6cnl by Molmil
Crystal Structure of H105A PGAM5 Dodecamer
Descriptor: MAGNESIUM ION, PGAM5 Multimerization Motif Peptide, Serine/threonine-protein phosphatase PGAM5, ...
Authors:Ruiz, K, Agnew, C, Jura, N.
Deposit date:2018-03-08
Release date:2019-02-13
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Functional role of PGAM5 multimeric assemblies and their polymerization into filaments.
Nat Commun, 10, 2019
6CNI
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BU of 6cni by Molmil
Crystal structure of H105A PGAM5 dimer
Descriptor: PHOSPHATE ION, SODIUM ION, Serine/threonine-protein phosphatase PGAM5, ...
Authors:Ruiz, K, Agnew, C, Jura, N.
Deposit date:2018-03-08
Release date:2019-02-13
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Functional role of PGAM5 multimeric assemblies and their polymerization into filaments.
Nat Commun, 10, 2019
3PR7
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BU of 3pr7 by Molmil
Multi-functional and mechanosensitive receptor binding activity of the Moraxella catarrhalis adhesin UspA1
Descriptor: UspA1
Authors:Agnew, C.R.J, Zaccai, N.R, Conners, R, Brady, R.L.
Deposit date:2010-11-29
Release date:2011-09-07
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.94 Å)
Cite:Correlation of in situ mechanosensitive responses of the Moraxella catarrhalis adhesin UspA1 with fibronectin and receptor CEACAM1 binding.
Proc.Natl.Acad.Sci.USA, 108, 2011
2QIH
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BU of 2qih by Molmil
Crystal structure of 527-665 fragment of UspA1 protein from Moraxella catarrhalis
Descriptor: CHLORIDE ION, PHOSPHATE ION, protein UspA1
Authors:Conners, R, Brady, R.L.
Deposit date:2007-07-04
Release date:2008-05-20
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.897 Å)
Cite:The Moraxella adhesin UspA1 binds to its human CEACAM1 receptor by a deformable trimeric coiled-coil.
Embo J., 27, 2008
5KTV
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BU of 5ktv by Molmil
Mis-pairing of unnatural base Z-G DNA duplex at pH 8.5
Descriptor: CALCIUM ION, DNA (5'-D(P*GP*CP*GP*AP*AP*TP*TP*(1W5)P*GP*CP*G)-3')
Authors:Ahmad Sobri, A.F, Brady, R.L.
Deposit date:2016-07-12
Release date:2017-05-03
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Structural Basis of the Mispairing of an Artificially Expanded Genetic Information System
Chemistry, 2017

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