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9FXO
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BU of 9fxo by Molmil
CRYO-EM STRUCTURE OF LEISHMANIA MAJOR 80S RIBOSOME WITH A/P/E-SITE TRNA AND MRNA : LM32CS1C1 M2 OE MUTANT
Descriptor: 1,4-DIAMINOBUTANE, 40S ribosomal protein S12, 40S ribosomal protein S14, ...
Authors:Rajan, K.S, Yonath, A.
Deposit date:2024-07-02
Release date:2025-07-23
Method:ELECTRON MICROSCOPY (2.25 Å)
Cite:CRYO-EM STRUCTURE OF LEISHMANIA MAJOR 80S RIBOSOME WITH A/P/E-SITE TRNA AND MRNA : LM32CS1C1 M2 OE MUTANT
To Be Published
6HX4
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BU of 6hx4 by Molmil
Fab fragment of a native monomer-selective antibody in complex with alpha-1-antitrypsin
Descriptor: Alpha-1-antitrypsin, Fab 1D9 heavy chain, Fab 1D9 light chain
Authors:Elliston, E.L.K, Miranda, E, Perez, J, Jagger, A.M, Lomas, D.A, Irving, J.A.
Deposit date:2018-10-15
Release date:2019-10-30
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Characterisation of a monoclonal antibody conformationally-selective for native alpha-1-antitrypsin
To Be Published
6ECK
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BU of 6eck by Molmil
Pyruvate Kinase Isoform L-type with phosphorylated Ser113 (pS113) in complex with FBP
Descriptor: 1,2-ETHANEDIOL, 1,6-di-O-phosphono-beta-D-fructofuranose, CITRATE ANION, ...
Authors:Padyana, A, Tong, S.
Deposit date:2018-08-08
Release date:2019-12-04
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.36 Å)
Cite:Distinct Hepatic PKA and CDK Signaling Pathways Control Activity-Independent Pyruvate Kinase Phosphorylation and Hepatic Glucose Production.
Cell Rep, 29, 2019
4BDG
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BU of 4bdg by Molmil
Fragment-based screening identifies a new area for inhibitor binding to checkpoint kinase 2 (CHK2)
Descriptor: 1,2-ETHANEDIOL, 3-(PYRIDIN-3-YL)-1H-PYRAZOL-5-AMINE, CHLORIDE ION, ...
Authors:Silva-Santisteban, M.C, Westwood, I.M, Boxall, K, Brown, N, Peacock, S, McAndrew, C, Barrie, E, Richards, M, Mirza, A, Oliver, A.W, Burke, R, Hoelder, S, Jones, K, Aherne, G.W, Blagg, J, Collins, I, Garrett, M.D, van Montfort, R.L.M.
Deposit date:2012-10-05
Release date:2013-06-26
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.84 Å)
Cite:Fragment-Based Screening Maps Inhibitor Interactions in the ATP-Binding Site of Checkpoint Kinase 2.
Plos One, 8, 2013
5CSJ
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BU of 5csj by Molmil
S100B-RSK1 crystal structure B
Descriptor: CALCIUM ION, CHLORIDE ION, Protein S100-B, ...
Authors:Gogl, G, Nyitray, L.
Deposit date:2015-07-23
Release date:2015-11-11
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structural Basis of Ribosomal S6 Kinase 1 (RSK1) Inhibition by S100B Protein: MODULATION OF THE EXTRACELLULAR SIGNAL-REGULATED KINASE (ERK) SIGNALING CASCADE IN A CALCIUM-DEPENDENT WAY.
J.Biol.Chem., 291, 2016
5TLH
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BU of 5tlh by Molmil
Fructose-1,6-bisphosphate aldolase from rabbit muscle in complex with the inhibitor 2-naphthol 6-bisphosphonate
Descriptor: Fructose-bisphosphate aldolase A, GLYCEROL, METHYLENEDIPHOSPHONIC ACID, ...
Authors:Heron, P.W, Sygusch, J.
Deposit date:2016-10-11
Release date:2017-10-25
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.204 Å)
Cite:Bisphosphonate Inhibitors of Mammalian Glycolytic Aldolase.
J.Med.Chem., 61, 2018
5CSN
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BU of 5csn by Molmil
S100B-RSK1 crystal structure C
Descriptor: CALCIUM ION, Protein S100-B, Ribosomal protein S6 kinase alpha-1
Authors:Gogl, G, Nyitray, L.
Deposit date:2015-07-23
Release date:2015-11-11
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Structural Basis of Ribosomal S6 Kinase 1 (RSK1) Inhibition by S100B Protein: MODULATION OF THE EXTRACELLULAR SIGNAL-REGULATED KINASE (ERK) SIGNALING CASCADE IN A CALCIUM-DEPENDENT WAY.
J.Biol.Chem., 291, 2016
4EDM
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BU of 4edm by Molmil
Crystal structure of beta-parvin CH2 domain
Descriptor: 1,2-ETHANEDIOL, Beta-parvin
Authors:Stiegler, A.L, Draheim, K.M, Li, X, Chayen, N.E, Calderwood, D.A, Boggon, T.J.
Deposit date:2012-03-27
Release date:2012-08-08
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural basis for paxillin binding and focal adhesion targeting of beta-parvin.
J.Biol.Chem., 287, 2012
5FIR
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BU of 5fir by Molmil
Crystal structure of C. elegans XRN2 in complex with the XRN2-binding domain of PAXT-1
Descriptor: 5'-3' EXORIBONUCLEASE 2 HOMOLOG, PAXT-1, SULFATE ION
Authors:Richter, H, Katic, I, Gut, H, Grosshans, H.
Deposit date:2015-10-02
Release date:2016-01-20
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.836 Å)
Cite:Structural Basis and Function of Xrn2-Binding by Xtb Domains
Nat.Struct.Mol.Biol., 23, 2016
1PLX
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BU of 1plx by Molmil
NMR structure of Methionine-Enkephalin in fast tumbling Bicelles/DMPG
Descriptor: Met-enkephalin 1
Authors:Marcotte, I, Separovic, F, Auger, M, Gagne, S.M.
Deposit date:2003-06-09
Release date:2004-03-16
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:A multidimensional (1)h NMR investigation of the conformation of methionine-enkephalin in fast-tumbling bicelles.
Biophys.J., 86, 2004
5T7H
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BU of 5t7h by Molmil
Crystal structure of dimeric yeast iso-1-cytochrome C with CYMAL6
Descriptor: 6-cyclohexylhexan-1-ol, Cytochrome c iso-1, HEME C, ...
Authors:Mcclelland, L, Mou, T.C, Sprang, S.R, Bowler, B.E.
Deposit date:2016-09-05
Release date:2017-03-22
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.003 Å)
Cite:Cytochrome c Can Form a Well-Defined Binding Pocket for Hydrocarbons.
J. Am. Chem. Soc., 138, 2016
6K9Z
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BU of 6k9z by Molmil
STRUCTURE OF URIDYLYLTRANSFERASE MUTANT
Descriptor: ACETATE ION, FE (III) ION, Galactose-1-phosphate uridylyltransferase, ...
Authors:Sakuraba, H, Ohshida, T, Yoneda, K, Ohshima, T.
Deposit date:2019-06-19
Release date:2019-12-18
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Unique active site formation in a novel galactose 1-phosphate uridylyltransferase from the hyperthermophilic archaeon Pyrobaculum aerophilum.
Proteins, 88, 2020
4J2J
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BU of 4j2j by Molmil
Crystal structure of AXH domain complex with Capicua
Descriptor: Ataxin-1, Protein capicua homolog
Authors:Song, J.-J, Kim, E.
Deposit date:2013-02-04
Release date:2013-04-03
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural basis of protein complex formation and reconfiguration by polyglutamine disease protein Ataxin-1 and Capicua
Genes Dev., 27, 2013
5CSX
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BU of 5csx by Molmil
CRYSTAL STRUCTURE OF B-RAF IN COMPLEX WITH BI 882370
Descriptor: N-(3-{5-[(1-ethylpiperidin-4-yl)(methyl)amino]-3-(pyrimidin-5-yl)-1H-pyrrolo[3,2-b]pyridin-1-yl}-2,4-difluorophenyl)propane-1-sulfonamide, Serine/threonine-protein kinase B-raf, alpha-D-glucopyranose
Authors:Bader, G, Stadtmuller, H, Steurer, S.
Deposit date:2015-07-23
Release date:2016-03-09
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:A Novel RAF Kinase Inhibitor with DFG-Out-Binding Mode: High Efficacy in BRAF-Mutant Tumor Xenograft Models in the Absence of Normal Tissue Hyperproliferation.
Mol.Cancer Ther., 15, 2016
1TYJ
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BU of 1tyj by Molmil
Crystal Structure Analysis of type II Cohesin A11 from Bacteroides cellulosolvens
Descriptor: 1,2-ETHANEDIOL, METHANOL, cellulosomal scaffoldin
Authors:Noach, I, Frolow, F, Jakoby, H, Rosenheck, S, Shimon, L.J.W, Lamed, R, Bayer, E.A.
Deposit date:2004-07-08
Release date:2005-04-26
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of a type-II cohesin module from the Bacteroides cellulosolvens cellulosome reveals novel and distinctive secondary structural elements
J.Mol.Biol., 348, 2005
6JWG
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BU of 6jwg by Molmil
Crystal structure of Formate dehydrogenase mutant C256I/E261P/S381I from Pseudomonas sp. 101
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Formate dehydrogenase, GLYCEROL
Authors:Feng, Y, Guo, X, Xue, S, Zhao, Z.
Deposit date:2019-04-20
Release date:2020-05-13
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.081 Å)
Cite:Structure-Guided Design of Formate Dehydrogenase for Regeneration of a Non-Natural Redox Cofactor.
Chemistry, 26, 2020
5CPV
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BU of 5cpv by Molmil
RESTRAINED LEAST SQUARES REFINEMENT OF NATIVE (CALCIUM) AND CADMIUM-SUBSTITUTED CARP PARVALBUMIN USING X-RAY CRYSTALLOGRAPHIC DATA AT 1.6-ANGSTROMS RESOLUTION
Descriptor: CALCIUM ION, CALCIUM-BINDING PARVALBUMIN B
Authors:Swain, A.L, Kretsinger, R.H, Amma, E.L.
Deposit date:1990-01-24
Release date:1990-10-15
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Restrained least squares refinement of native (calcium) and cadmium-substituted carp parvalbumin using X-ray crystallographic data at 1.6-A resolution.
J.Biol.Chem., 264, 1989
9G9X
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BU of 9g9x by Molmil
Structure of the human two pore domain potassium ion channel TASK-1 (K2P3.1)
Descriptor: CHOLESTEROL HEMISUCCINATE, POTASSIUM ION, Potassium channel subfamily K member 3
Authors:Rodstrom, K.E.J, Hall, P.H, Tucker, S.J.
Deposit date:2024-07-25
Release date:2024-12-18
Last modified:2025-01-15
Method:ELECTRON MICROSCOPY (3.13 Å)
Cite:Structures of TASK-1 and TASK-3 K2P channels provide insight into their gating and dysfunction in disease.
Structure, 33, 2025
6Q54
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BU of 6q54 by Molmil
Structure of GluA2 ligand-binding domain (S1S2J) in complex with the agonist (S)-2-Amino-3-(1-ethyl-4-hydroxy-1H-1,2,3-triazol-5-yl)propanoic acid at 1.4 A resolution
Descriptor: (2~{S})-2-azanyl-3-(3-ethyl-5-oxidanyl-1,2,3-triazol-4-yl)propanoic acid, CHLORIDE ION, CITRIC ACID, ...
Authors:Moellerud, S, Temperini, P, Kastrup, J.S.
Deposit date:2018-12-07
Release date:2019-04-17
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Use of the 4-Hydroxytriazole Moiety as a Bioisosteric Tool in the Development of Ionotropic Glutamate Receptor Ligands.
J.Med.Chem., 62, 2019
1ZDV
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BU of 1zdv by Molmil
Solution Structure of the type 1 pilus assembly platform FimD(25-139)
Descriptor: Outer membrane usher protein fimD
Authors:Nishiyama, M, Horst, R, Herrmann, T, Vetsch, M, Bettendorff, P, Ignatov, O, Grutter, M, Wuthrich, K, Glockshuber, R, Capitani, G.
Deposit date:2005-04-15
Release date:2005-06-14
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Structural basis of chaperone-subunit complex recognition by the type 1 pilus assembly platform FimD.
Embo J., 24, 2005
7B2O
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BU of 7b2o by Molmil
Crystal structure of Chlamydomonas reinhardtii chloroplastic sedoheptulose-1,7-bisphosphatase
Descriptor: FBPase domain-containing protein
Authors:Le Moigne, T, Lemaire, S.D, Henri, J.
Deposit date:2020-11-27
Release date:2021-12-08
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (3.09 Å)
Cite:Crystal structure of Chlamydomonas reinhardtii chloroplastic sedoheptulose-1,7-bisphosphatas
To Be Published
2Z73
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BU of 2z73 by Molmil
Crystal structure of squid rhodopsin
Descriptor: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, DOCOSANE, PALMITIC ACID, ...
Authors:Murakami, M, Kouyama, T.
Deposit date:2007-08-13
Release date:2008-05-13
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of squid rhodopsin.
Nature, 453, 2008
4ZLG
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BU of 4zlg by Molmil
Cellobionic acid phosphorylase - gluconic acid complex
Descriptor: CHLORIDE ION, D-gluconic acid, D-glucono-1,5-lactone, ...
Authors:Nam, Y.W, Arakawa, T, Fushinobu, S.
Deposit date:2015-05-01
Release date:2015-06-10
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Crystal Structure and Substrate Recognition of Cellobionic Acid Phosphorylase, Which Plays a Key Role in Oxidative Cellulose Degradation by Microbes.
J.Biol.Chem., 290, 2015
5D5X
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BU of 5d5x by Molmil
Crystal structure of Chaetomium thermophilum Skn7 with SSRE DNA
Descriptor: Putative transcription factor, SSRE DNA strand 1, SSRE DNA strand 2
Authors:Neudegger, T, Verghese, J, Hayer-Hartl, M, Hartl, F.U, Bracher, A.
Deposit date:2015-08-11
Release date:2015-12-30
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure of human heat-shock transcription factor 1 in complex with DNA.
Nat.Struct.Mol.Biol., 23, 2016
1Q99
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BU of 1q99 by Molmil
Crystal structure of the Saccharomyces cerevisiae SR protein kinsae, Sky1p, complexed with the non-hydrolyzable ATP analogue, AMP-PNP
Descriptor: 1,2-ETHANEDIOL, METHANOL, NICKEL (II) ION, ...
Authors:Nolen, B, Ngo, J, Chakrabarti, S, Vu, D, Adams, J.A, Ghosh, G.
Deposit date:2003-08-22
Release date:2003-09-23
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Nucleotide-Induced Conformational Changes in the Saccharomyces cerevisiae SR Protein Kinase, Sky1p, Revealed by X-ray Crystallography
Biochemistry, 42, 2003

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