PDB: 419 resultsInfo pagesStatus searchChemie searchBIRD

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7QTX	Kaposi sarcoma associated herpes virus (KSHV) encoded apoptosis inhibitor, KsBcl-2 in complex with Puma BH3 Descriptor: 1,2-ETHANEDIOL, BROMIDE ION, Bcl-2, ... Authors: Suraweera, C.D, Hinds, M.G, Kvansakul, M. Deposit date: 2022-01-17 Release date: 2022-11-23 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (2.11598849 Å) Cite: Structural Insight into KsBcl-2 Mediated Apoptosis Inhibition by Kaposi Sarcoma Associated Herpes Virus. Viruses, 14, 2022
8CZH	Human BAK in complex with the dM2 peptide Descriptor: Bcl-2 homologous antagonist/killer, DM2 peptide Authors: Aguilar, F, Keating, A.E. Deposit date: 2022-05-24 Release date: 2023-01-11 Last modified: 2024-10-09 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Peptides from human BNIP5 and PXT1 and non-native binders of pro-apoptotic BAK can directly activate or inhibit BAK-mediated membrane permeabilization. Structure, 31, 2023
8CZF	Human BAK in complex with the dF2 peptide Descriptor: Bcl-2 homologous antagonist/killer, DF2 peptide Authors: Aguilar, F, Keating, A.E. Deposit date: 2022-05-24 Release date: 2023-01-11 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Peptides from human BNIP5 and PXT1 and non-native binders of pro-apoptotic BAK can directly activate or inhibit BAK-mediated membrane permeabilization. Structure, 31, 2023
8CZG	Human BAK in complex with the dF3 peptide Descriptor: Bcl-2 homologous antagonist/killer, dF3 peptide Authors: Aguilar, F, Keating, A.E. Deposit date: 2022-05-24 Release date: 2023-01-11 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (1.99 Å) Cite: Peptides from human BNIP5 and PXT1 and non-native binders of pro-apoptotic BAK can directly activate or inhibit BAK-mediated membrane permeabilization. Structure, 31, 2023
1F16	SOLUTION STRUCTURE OF A PRO-APOPTOTIC PROTEIN BAX Descriptor: PROTEIN (APOPTOSIS REGULATOR BAX, MEMBRANE ISOFORM ALPHA) Authors: Suzuki, M, Youle, R.J, Tjandra, N. Deposit date: 2000-05-18 Release date: 2000-11-22 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: Structure of Bax: coregulation of dimer formation and intracellular localization. Cell(Cambridge,Mass.), 103, 2000
4WMR	STRUCTURE OF MCL1 BOUND TO BRD inhibitor ligand 1 AT 1.7A Descriptor: 7-[2-(1H-imidazol-1-yl)-4-methylpyridin-3-yl]-3-[3-(naphthalen-1-yloxy)propyl]-1-[2-oxo-2-(piperazin-1-yl)ethyl]-1H-indole-2-carboxylic acid, Induced myeloid leukemia cell differentiation protein Mcl-1, PYROPHOSPHATE 2-, ... Authors: CLIFTON, M.C, EDWARDS, T.E. Deposit date: 2014-10-09 Release date: 2015-05-06 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (1.7 Å) Cite: A Maltose-Binding Protein Fusion Construct Yields a Robust Crystallography Platform for MCL1. Plos One, 10, 2015
5IEZ	Discovery of Potent Myeloid Cell Leukemia-1 (Mcl-1) inhibitors using Structure-Based Design Descriptor: 3-({6-chloro-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-7-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-indole-2-carbonyl}amino)benzoic acid, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Zhao, B. Deposit date: 2016-02-25 Release date: 2017-01-18 Last modified: 2024-03-06 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Discovery and biological characterization of potent myeloid cell leukemia-1 inhibitors. FEBS Lett., 591, 2017
4OYD	Crystal structure of a computationally designed inhibitor of an Epstein-Barr viral Bcl-2 protein Descriptor: 1,2-ETHANEDIOL, Apoptosis regulator BHRF1, Computationally designed Inhibitor Authors: Shen, B, Procko, E, Baker, D, Stoddard, B. Deposit date: 2014-02-11 Release date: 2014-07-09 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (1.8 Å) Cite: A computationally designed inhibitor of an epstein-barr viral bcl-2 protein induces apoptosis in infected cells. Cell, 157, 2014
4OQ5	Crystal Structure of Human MCL-1 Bound to Inhibitor 4-(4-methylnaphthalen-1-yl)-2-{[(4-phenoxyphenyl)sulfonyl]amino}benzoic acid Descriptor: 4-(4-methylnaphthalen-1-yl)-2-{[(4-phenoxyphenyl)sulfonyl]amino}benzoic acid, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Petros, A.M, Swann, S.L, Song, D, Swinger, K, Park, C, Zhang, H, Wendt, M.D, Kunzer, A.R, Souers, A.J, Sun, C. Deposit date: 2014-02-07 Release date: 2014-03-12 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.86 Å) Cite: Fragment-based discovery of potent inhibitors of the anti-apoptotic MCL-1 protein. Bioorg.Med.Chem.Lett., 24, 2014
5C6H	Mcl-1 complexed with Mule Descriptor: Induced myeloid leukemia cell differentiation protein Mcl-1, Mule BH3 peptide from E3 ubiquitin-protein ligase HUWE1 Authors: Song, T, Wang, Z, Ji, F, Chai, G, Liu, Y, Li, X, Li, Z, Fan, Y, Zhang, Z. Deposit date: 2015-06-23 Release date: 2016-08-03 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.05 Å) Cite: Structure of Mcl-1 complexed with Mule at 2.05 Angstroms resolution To Be Published
3PK1	Crystal structure of Mcl-1 in complex with the BaxBH3 domain Descriptor: Apoptosis regulator BAX, CADMIUM ION, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Czabotar, P.E, Colman, P.M. Deposit date: 2010-11-11 Release date: 2010-12-29 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.486 Å) Cite: Mutation to Bax beyond the BH3 domain disrupts interactions with pro-survival proteins and promotes apoptosis J.Biol.Chem., 286, 2011
3QBR	BakBH3 in complex with sjA Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Bcl-2 homologous antagonist/killer, SJCHGC06286 protein Authors: Lee, E.F, Clarke, O.B, Fairlie, W.D, Colman, P.M, Evangelista, M, Feng, Z, Speed, T.P, Tchoubrieva, E, Strasser, A, Kalinna, B. Deposit date: 2011-01-13 Release date: 2011-04-13 Last modified: 2017-11-08 Method: X-RAY DIFFRACTION (2.601 Å) Cite: Discovery and molecular characterization of a Bcl-2-regulated cell death pathway in schistosomes. Proc.Natl.Acad.Sci.USA, 108, 2011
4OQ6	Crystal Structure of Human MCL-1 Bound to Inhibitor 4-hydroxy-4'-propylbiphenyl-3-carboxylic acid Descriptor: 4-hydroxy-4'-propylbiphenyl-3-carboxylic acid, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Petros, A.M, Swann, S.L, Song, D, Swinger, K, Park, C, Zhang, H, Wendt, M.D, Kunzer, A.R, Souers, A.J, Sun, C. Deposit date: 2014-02-07 Release date: 2014-03-12 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.81 Å) Cite: Fragment-based discovery of potent inhibitors of the anti-apoptotic MCL-1 protein. Bioorg.Med.Chem.Lett., 24, 2014
5KU9	Crystal structure of MCL1 with compound 1 Descriptor: (3~{S})-3-azanyl-4-(4-bromophenyl)-~{N}-[(3~{S})-1-[2-[[(2~{R})-1-(3,4-dichlorophenyl)-4-(methylamino)-4-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]-2-oxidanylidene-4,5-dihydro-3~{H}-1-benzazepin-3-yl]butanamide, Induced myeloid leukemia cell differentiation protein Mcl-1, SODIUM ION Authors: Ferguson, A.D. Deposit date: 2016-07-13 Release date: 2017-01-11 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Structure Based Design of Non-Natural Peptidic Macrocyclic Mcl-1 Inhibitors. ACS Med Chem Lett, 8, 2017
5JSB	Crystal structure of Mcl1-inhibitor complex Descriptor: Induced myeloid leukemia cell differentiation protein Mcl-1, Mcl-1 inhibitor Authors: Shen, B.W, Stoddard, B.L. Deposit date: 2016-05-07 Release date: 2016-11-16 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.74 Å) Cite: Computationally designed high specificity inhibitors delineate the roles of BCL2 family proteins in cancer. Elife, 5, 2016
5C3F	Crystal structure of Mcl-1 bound to BID-MM Descriptor: BID-MM, GLYCEROL, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Miles, J.A, Yeo, D.J, Rowell, P, Rodriguez-Marin, S, Pask, C.M, Warriner, S.L, Edwards, T.A, Wilson, A.J. Deposit date: 2015-06-17 Release date: 2016-04-20 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.43 Å) Cite: Hydrocarbon constrained peptides - understanding preorganisation and binding affinity. Chem Sci, 7, 2016
7LK4	Crystal structure of BAK L100A in complex with activating antibody fragments Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 7D10 antibody VH fragment, 7D10 antibody VL fragment, ... Authors: Robin, Y.A, Colman, P.M. Deposit date: 2021-02-01 Release date: 2022-02-09 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (3.1 Å) Cite: Structure of the BAK-activating antibody 7D10 bound to BAK reveals an unexpected role for the alpha 1-alpha 2 loop in BAK activation. Cell Death Differ., 29, 2022
7M5B	Crystal Structure of human BAK in complex with M3W5_BID Descriptor: BH3-interacting domain death agonist p15, Bcl-2 homologous antagonist/killer, COPPER (II) ION Authors: Singh, G, Aggarwal, A, Moldoveanu, T. Deposit date: 2021-03-23 Release date: 2022-01-12 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Structural basis of BAK activation in mitochondrial apoptosis initiation. Nat Commun, 13, 2022
7JMT	Crystal structure of schistosome BCL-2 bound to ABT-737 Descriptor: 4-{4-[(4'-CHLOROBIPHENYL-2-YL)METHYL]PIPERAZIN-1-YL}-N-{[4-({(1R)-3-(DIMETHYLAMINO)-1-[(PHENYLTHIO)METHYL]PROPYL}AMINO)-3-NITROPHENYL]SULFONYL}BENZAMIDE, BCL-2 protein Authors: Smith, N.A, Smith, B.J, Lee, E.F, Colman, P.M, Fairlie, W.D. Deposit date: 2020-08-02 Release date: 2021-02-17 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.75 Å) Cite: Optimization of Benzothiazole and Thiazole Hydrazones as Inhibitors of Schistosome BCL-2. Acs Infect Dis., 7, 2021
7K02	The crystal structure of a BAK dimer activated by detergent Descriptor: Bcl-2 homologous antagonist/killer Authors: Birkinshaw, R.W, Czabotar, P.E. Deposit date: 2020-09-02 Release date: 2021-03-31 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (3.4 Å) Cite: Structure of detergent-activated BAK dimers derived from the inert monomer. Mol.Cell, 81, 2021
7NB4	Structure of Mcl-1 complex with compound 1 Descriptor: (2~{R})-2-[[5-(3-chloranyl-2-methyl-phenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-yl]amino]-3-phenyl-propanoic acid, 1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE, Induced myeloid leukemia cell differentiation protein Mcl-1, ... Authors: Dokurno, P, Surgenor, A.E, Kotschy, A. Deposit date: 2021-01-25 Release date: 2021-10-13 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.9 Å) Cite: The Effect of Core Replacement on S64315, a Selective MCL-1 Inhibitor, and Its Analogues. Acs Omega, 6, 2021
7NB7	Structure of Mcl-1 complex with compound 6b Descriptor: (2~{R})-2-[[7-but-2-ynyl-5-(3-chloranyl-2-methyl-phenyl)-6-ethyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-3-phenyl-propanoic acid, Induced myeloid leukemia cell differentiation protein Mcl-1 Authors: Dokurno, P, Surgenor, A.E, Kotschy, A. Deposit date: 2021-01-25 Release date: 2021-10-13 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (2.82 Å) Cite: The Effect of Core Replacement on S64315, a Selective MCL-1 Inhibitor, and Its Analogues. Acs Omega, 6, 2021
7M5C	Crystal Structure of human BAK in complex with WT BAK BH3 peptide Descriptor: Bcl-2 homologous antagonist/killer, COPPER (II) ION, SULFATE ION Authors: Singh, G, Aggarwal, A, Moldoveanu, T. Deposit date: 2021-03-23 Release date: 2022-01-12 Last modified: 2024-10-09 Method: X-RAY DIFFRACTION (3.06 Å) Cite: Structural basis of BAK activation in mitochondrial apoptosis initiation. Nat Commun, 13, 2022
7M5A	Crystal Structure of human BAK in complex with W3W5_BID Descriptor: BH3-interacting domain death agonist p15, Bcl-2 homologous antagonist/killer Authors: Singh, G, Aggarwal, A, Moldoveanu, T. Deposit date: 2021-03-23 Release date: 2022-01-12 Last modified: 2024-10-09 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structural basis of BAK activation in mitochondrial apoptosis initiation. Nat Commun, 13, 2022
1Q59	Solution Structure of the BHRF1 Protein From Epstein-Barr Virus, a Homolog of Human Bcl-2 Descriptor: Early antigen protein R Authors: Huang, Q, Petros, A.M, Virgin, H.W, Fesik, S.W, Olejniczak, E.T. Deposit date: 2003-08-06 Release date: 2003-09-23 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: Solution Structure of the BHRF1 Protein From Epstein-Barr Virus, a Homolog of Human Bcl-2 J.Mol.Biol., 332, 2003

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