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All PDB entries with NMR restraints data
8ZUG
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BU of 8zug by Molmil
Human Keratin 19 head domain segment Y6-G28 in solution
Descriptor: Keratin, type I cytoskeletal 19
Authors:Ji, Y, Jeong, M, Kim, J, Lee, C.H.
Deposit date:2024-06-09
Release date:2024-08-21
Method:SOLUTION NMR
Cite:Human Keratin 19 head domain segment Y6-G28 in solution
To Be Published
9ATN
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BU of 9atn by Molmil
NMR structure of the MLL4 PHD2/3 fingers in complex with ASXL2
Descriptor: Histone-lysine N-methyltransferase 2D, Polycomb group protein ASXL2, ZINC ION
Authors:Zhang, Y, Zandian, M, Kutateladze, T.
Deposit date:2024-02-27
Release date:2024-06-19
Method:SOLUTION NMR
Cite:ASXLs binding to the PHD2/3 fingers of MLL4 provides a mechanism for the recruitment of BAP1 to active enhancers.
Nat Commun, 15, 2024
9AZI
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BU of 9azi by Molmil
NMR solution structure of cell-permeant miniature protein ZF5.3
Descriptor: Designed Zinc finger protein 5.3, ZINC ION
Authors:Giudice, J.A, Kelly, M, Schepartz, A.
Deposit date:2024-03-11
Release date:2024-05-01
Method:SOLUTION NMR
Cite:Structural and mechanistic basis for efficient endosomal escape by designed mini-proteins
To be published
9BAF
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BU of 9baf by Molmil
Solution NMR structure of conofurin-Delta
Descriptor: Alpha-conotoxin LvIA
Authors:Harvey, P.J, Craik, D.J, Hone, A.J, McIntosh, J.M.
Deposit date:2024-04-04
Release date:2024-07-03
Method:SOLUTION NMR
Cite:Design, Synthesis, and Structure-Activity Relationships of Novel Peptide Derivatives of the Severe Acute Respiratory Syndrome-Coronavirus-2 Spike-Protein that Potently Inhibit Nicotinic Acetylcholine Receptors.
J.Med.Chem., 67, 2024
9BB1
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BU of 9bb1 by Molmil
Backbone Modification in the GA Module of Protein PAB: Wild-type Sequence
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BB2
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BU of 9bb2 by Molmil
Backbone Modification in the GA Module of Protein PAB: beta3-residues at positions 20 and 24
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BB3
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BU of 9bb3 by Molmil
Backbone Modification in the GA Module of Protein PAB: beta3-residues at positions 22 and 26
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BB4
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BU of 9bb4 by Molmil
Backbone Modification in the GA Module of Protein PAB: beta3-residues at positions 23 and 26
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BB5
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BU of 9bb5 by Molmil
Backbone Modification in the GA Module of Protein PAB: ACPC residues at positions 22 and 26
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BB6
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BU of 9bb6 by Molmil
Backbone Modification in the GA Module of Protein PAB: ACPC residues at positions 5 and 13, beta3 residue at position 9
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BB7
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BU of 9bb7 by Molmil
Backbone Modification in the GA Module of Protein PAB: ACPC residues at positions 5 and 39, beta3 residue at position 26
Descriptor: Peptostreptococcal albumin-binding protein
Authors:Lin, Y, Horne, W.S.
Deposit date:2024-04-05
Release date:2024-06-05
Last modified:2024-08-21
Method:SOLUTION NMR
Cite:Backbone Modification in a Protein Hydrophobic Core.
Chemistry, 30, 2024
9BD0
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BU of 9bd0 by Molmil
Solution Structure of a Disulfide Insertion Mutant of S. aureus SPIN
Descriptor: Myeloperoxidase inhibitor SPIN
Authors:Mishra, N.B, Prakash, O, Geisbrecht, B.V.
Deposit date:2024-04-10
Release date:2024-05-29
Last modified:2024-07-03
Method:SOLUTION NMR
Cite:Staphylococcal peroxidase inhibitor (SPIN): Investigation of the inhibitory N-terminal domain via a stabilizing disulfide insertion.
Arch.Biochem.Biophys., 758, 2024
9BFL
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BU of 9bfl by Molmil
Solution structure of the scorpion toxin omega-Buthitoxin-Hf1a
Descriptor: Buthitoxin-Hf1a
Authors:Rosengren, K.J, Payne, C.D.
Deposit date:2024-04-18
Release date:2024-06-05
Method:SOLUTION NMR
Cite:Novel Scorpion Toxin omega-Buthitoxin-Hf1a Selectively Inhibits Calcium Influx via Ca V 3.3 and Ca V 3.2 and Alleviates Allodynia in a Mouse Model of Acute Postsurgical Pain.
Int J Mol Sci, 25, 2024
9BHN
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BU of 9bhn by Molmil
Solution NMR structure of halichondamide A, a fused bicyclic cysteine knot undecapeptide from the marine sponge Halichondria bowerbanki
Descriptor: Halichondamide A
Authors:Agarwal, V, McShan, A.C, Zhong, W.
Deposit date:2024-04-21
Release date:2024-08-21
Last modified:2024-09-25
Method:SOLUTION NMR
Cite:Discovery and Folding Dynamics of a Fused Bicyclic Cysteine Knot Undecapeptide from the Marine Sponge Halichondria bowerbanki.
J.Org.Chem., 89, 2024
9BV0
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BU of 9bv0 by Molmil
NMR structure of the Z0 CCHC zinc-finger of transcription repressor Bcl11A
Descriptor: B-cell lymphoma/leukemia 11A, ZINC ION
Authors:Alexandrescu, A.T.
Deposit date:2024-05-18
Release date:2024-05-29
Method:SOLUTION NMR
Cite:NMR structure of the Z0 CCHC zinc-finger of transcription repressor Bcl11A
To Be Published
9BVS
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BU of 9bvs by Molmil
NMR structure of TLP-1 in solution
Descriptor: Temporin-1Tl
Authors:Jia, R, McShan, A.C.
Deposit date:2024-05-20
Release date:2024-06-05
Method:SOLUTION NMR
Cite:Design and Development of Temporin L Analogues to Inhibit the Main Protease of SARS-CoV-2
To Be Published
9BVU
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BU of 9bvu by Molmil
NMR structure of TLP-2 in solution
Descriptor: Temporin-1Tl
Authors:Jia, R, McShan, A.C.
Deposit date:2024-05-20
Release date:2024-06-05
Method:SOLUTION NMR
Cite:Design and Development of Temporin L Analogues to Inhibit the Main Protease of SARS-CoV-2
To Be Published
9BVV
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BU of 9bvv by Molmil
NMR structure of TLP-3 in solution
Descriptor: Temporin-1Tl
Authors:Jia, R, McShan, A.C.
Deposit date:2024-05-20
Release date:2024-06-05
Method:SOLUTION NMR
Cite:Design and Development of Temporin L Analogues to Inhibit the Main Protease of SARS-CoV-2
To Be Published
9C5E
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BU of 9c5e by Molmil
Covalent Complex Between Parkin Catalytic (Rcat) Domain and Ubiquitin
Descriptor: E3 ubiquitin-protein ligase parkin, Polyubiquitin-B, ZINC ION
Authors:Connelly, E.M, Rintala-Dempsey, A.C, Gundogdu, M, Freeman, E.A, Koszela, J, Aguirre, J.D, Zhu, G, Kamarainen, O, Tadayon, R, Walden, H, Shaw, G.S.
Deposit date:2024-06-06
Release date:2024-08-14
Last modified:2024-10-09
Method:SOLUTION NMR
Cite:Capturing the catalytic intermediates of parkin ubiquitination.
Proc.Natl.Acad.Sci.USA, 121, 2024
9CE9
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BU of 9ce9 by Molmil
Solution NMR structure of the fungal loosenin PcaLOOL12 from Phanerochaete carnosa
Descriptor: RlpA-like protein double-psi beta-barrel domain-containing protein
Authors:Buchko, G.W, Master, E.R.
Deposit date:2024-06-26
Release date:2024-07-10
Last modified:2024-07-17
Method:SOLUTION NMR
Cite:Bio-SANS investigation of fungal loosenins reveal substrate dependent impacts of protein action on inter-fibril distance and packing order of cellulosic substrates
To Be Published
9CEQ
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BU of 9ceq by Molmil
Lanthanide Binding Tag complex LBT3-NH2:La3+
Descriptor: LANTHANUM (III) ION, Lanthanide Binding Tag Peptide
Authors:Kt, S, Messinger, R.J, Favaro, D.C.
Deposit date:2024-06-27
Release date:2024-07-17
Method:SOLUTION NMR
Cite:Role of Water in the Selective Complexation of Rare Earth Elements by Lanthanide Binding Tag Peptides
To Be Published
9CJA
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BU of 9cja by Molmil
Formerly degenerate seventh zinc finger domain from transcription factor ZNF711 rehabilitated by experimental NMR structure
Descriptor: ZINC ION, Zinc finger protein 711
Authors:Rua, A.J, Alexandrescu, A.T.
Deposit date:2024-07-05
Release date:2024-07-17
Last modified:2024-10-09
Method:SOLUTION NMR
Cite:Formerly degenerate seventh zinc finger domain from transcription factor ZNF711 rehabilitated by experimental NMR structure.
Protein Sci., 33, 2024
9COJ
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BU of 9coj by Molmil
SH3-like tandem domain of human KIN protein
Descriptor: DNA/RNA-binding protein KIN17
Authors:de Lourenco, I.O, Fossey, M.A, Souza, F.P, Seixas, F.A.V, Fernandez, M.A, Almeida, F.C.L, Caruso, I.P.
Deposit date:2024-07-16
Release date:2024-07-31
Method:SOLUTION NMR
Cite:Solution structure of SH3-like tandem domain of human KIN protein and its interaction with RNA homo-oligonucleotides
To Be Published
9CPD
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BU of 9cpd by Molmil
Structures of small molecules bound to RNA repeat expansions that cause Huntington's disease-like 2 and myotonic dystrophy type 1
Descriptor: 4-[(3-methoxyphenyl)amino]-2-methylquinoline-6-carboximidamide, RNA (5'-R(*GP*AP*CP*AP*GP*CP*UP*GP*CP*UP*GP*UP*C)-3')
Authors:Chen, J.L, Taghavi, A, Disney, M.D, Fountain, M.A, Childs-Disney, J.L.
Deposit date:2024-07-18
Release date:2024-08-07
Last modified:2024-08-14
Method:SOLUTION NMR
Cite:NMR structures of small molecules bound to a model of a CUG RNA repeat expansion.
Bioorg.Med.Chem.Lett., 111, 2024
9CPG
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BU of 9cpg by Molmil
Structures of small molecules bound to RNA repeat expansions that cause Huntington's disease-like 2 and myotonic dystrophy type 1
Descriptor: 4-carbamimidamidophenyl 4-carbamimidamidobenzoate, RNA (5'-R(*GP*AP*CP*AP*GP*CP*UP*GP*CP*UP*GP*UP*C)-3')
Authors:Chen, J.L, Taghavi, A, Disney, M.D, Fountain, M.A, Childs-Disney, J.L.
Deposit date:2024-07-18
Release date:2024-08-07
Method:SOLUTION NMR
Cite:Structures of small molecules bound to RNA repeat expansions that cause Huntington's disease-like 2 and myotonic dystrophy type 1.
Bioorg.Med.Chem.Lett., 2024

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