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5TIJ
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BU of 5tij by Molmil
Structure of Human Enolase 2 with ((3S,5S)-1,5-dihydroxy-3-methyl-2-oxopyrrolidin-3-yl)phosphonate (purified enantiomer)
Descriptor: ((3S,5S)-1,5-dihydroxy-3-methyl-2-oxopyrrolidin-3-yl)phosphonic acid, Gamma-enolase, MAGNESIUM ION
Authors:Leonard, P.G, Muller, F.L.
Deposit date:2016-10-03
Release date:2017-10-18
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.634 Å)
Cite:Eradication of ENO1-deleted Glioblastoma through Collateral Lethality
Biorxiv, 2019
5TGY
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BU of 5tgy by Molmil
NMR structure of holo-PS1
Descriptor: PS1, [5,10,15,20-tetrakis(trifluoromethyl)porphyrinato(2-)-kappa~4~N~21~,N~22~,N~23~,N~24~]zinc
Authors:Polizzi, N.F, Wu, Y.
Deposit date:2016-09-28
Release date:2017-08-09
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:De novo design of a hyperstable non-natural protein-ligand complex with sub- angstrom accuracy.
Nat Chem, 9, 2017
5TGW
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BU of 5tgw by Molmil
NMR structure of apo-PS1
Descriptor: PS1
Authors:Polizzi, N.F, Wu, Y.
Deposit date:2016-09-28
Release date:2017-08-09
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:De novo design of a hyperstable non-natural protein-ligand complex with sub- angstrom accuracy.
Nat Chem, 9, 2017
4MAX
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BU of 4max by Molmil
Crystal structure of Synechococcus sp. PCC 7002 globin at cryogenic temperature with heme modification
Descriptor: HEME B/C, SULFATE ION, cyanoglobin
Authors:Wenke, B.B, Schlessman, J.L, Heroux, A, Lecomte, J.T.J.
Deposit date:2013-08-18
Release date:2013-08-28
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.444 Å)
Cite:The 2/2 hemoglobin from the cyanobacterium Synechococcus sp. PCC 7002 with covalently attached heme: Comparison of X-ray and NMR structures.
Proteins, 82, 2014
3MAX
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BU of 3max by Molmil
Crystal Structure of Human HDAC2 complexed with an N-(2-aminophenyl)benzamide
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, CALCIUM ION, Histone deacetylase 2, ...
Authors:Skene, R.J, Jennings, A.J.
Deposit date:2010-03-24
Release date:2010-04-28
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Exploration of the HDAC2 foot pocket: Synthesis and SAR of substituted N-(2-aminophenyl)benzamides.
Bioorg.Med.Chem.Lett., 20, 2010
2MAX
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BU of 2max by Molmil
NMR structure of the RNA polymerase alpha subunit C-terminal domain from Helicobacter pylori
Descriptor: DNA-directed RNA polymerase subunit alpha
Authors:Borin, B.N, Krezel, A.M.
Deposit date:2013-07-21
Release date:2014-03-12
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Helicobacter pylori RNA polymerase alpha-subunit C-terminal domain shows features unique to -proteobacteria and binds NikR/DNA complexes.
Protein Sci., 23, 2014
6MAX
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BU of 6max by Molmil
Crystal structure of Ribonuclease P protein from Thermotoga maritima in complex with purpurin
Descriptor: Purpurin, Ribonuclease P protein component, SULFATE ION
Authors:Torres-Larios, A, Madrigal-Carrillo, E.A.
Deposit date:2018-08-28
Release date:2019-04-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:A screening platform to monitor RNA processing and protein-RNA interactions in ribonuclease P uncovers a small molecule inhibitor.
Nucleic Acids Res., 47, 2019
1MAX
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BU of 1max by Molmil
BETA-TRYPSIN PHOSPHONATE INHIBITED
Descriptor: BETA-TRYPSIN, CALCIUM ION, [N-(BENZYLOXYCARBONYL)AMINO](4-AMIDINOPHENYL)METHANE-PHOSPHONATE
Authors:Bertrand, J, Oleksyszyn, J, Kam, C, Boduszek, B, Presnell, S, Plaskon, R, Suddath, F, Powers, J, Williams, L.
Deposit date:1996-02-06
Release date:1996-10-14
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Inhibition of trypsin and thrombin by amino(4-amidinophenyl)methanephosphonate diphenyl ester derivatives: X-ray structures and molecular models.
Biochemistry, 35, 1996
7MAX
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BU of 7max by Molmil
SARS-CoV-2 Main Protease (Mpro) in Complex with Covalent Inhibitor SM137
Descriptor: 3C-like proteinase, D-phenylalanyl-N-{(2R)-5-ethoxy-5-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]pentan-2-yl}-4-fluoro-L-phenylalaninamide
Authors:Lockbaum, G.J, Schiffer, C.A.
Deposit date:2021-03-31
Release date:2022-10-12
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:SARS-CoV-2 Main Protease (Mpro) in Complex with Covalent Inhibitor SM137
To Be Published
4ZJK
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BU of 4zjk by Molmil
FIVE MINUTES IRON LOADED HUMAN H FERRITIN
Descriptor: CHLORIDE ION, FE (II) ION, Ferritin heavy chain, ...
Authors:Pozzi, C, Di Pisa, F, Mangani, S.
Deposit date:2015-04-29
Release date:2015-09-09
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Iron binding to human heavy-chain ferritin.
Acta Crystallogr.,Sect.D, 71, 2015
4OYN
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BU of 4oyn by Molmil
Fifteen minutes iron loaded human H ferritin
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, BICINE, CHLORIDE ION, ...
Authors:Pozzi, C, Di Pisa, F, Mangani, S.
Deposit date:2014-02-12
Release date:2015-09-09
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.43 Å)
Cite:Iron binding to human heavy-chain ferritin.
Acta Crystallogr.,Sect.D, 71, 2015
4YKH
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BU of 4ykh by Molmil
Thirty minutes iron loaded human H ferritin
Descriptor: BICINE, CHLORIDE ION, FE (II) ION, ...
Authors:Pozzi, C, Di Pisa, F, Mangani, S.
Deposit date:2015-03-04
Release date:2015-09-09
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Iron binding to human heavy-chain ferritin.
Acta Crystallogr.,Sect.D, 71, 2015
4Y08
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BU of 4y08 by Molmil
ONE MINUTE IRON LOADED HUMAN H FERRITIN
Descriptor: CHLORIDE ION, FE (II) ION, Ferritin heavy chain, ...
Authors:Pozzi, C, Di Pisa, F, Mangani, S.
Deposit date:2015-02-05
Release date:2015-09-23
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.34 Å)
Cite:Iron binding to human heavy-chain ferritin.
Acta Crystallogr.,Sect.D, 71, 2015
1OEY
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BU of 1oey by Molmil
Heterodimer of p40phox and p67phox PB1 domains from human NADPH oxidase
Descriptor: NEUTROPHIL CYTOSOL FACTOR 2, NEUTROPHIL CYTOSOL FACTOR 4
Authors:Wilson, M.I, Gill, D.J, Perisic, O, Quinn, M.T, Williams, R.L.
Deposit date:2003-04-02
Release date:2003-07-29
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:Pb1 Domain-Mediated Heterodimerization in Nadph Oxidase and Signaling Complexes of Atypical Protein Kinase C with Par6 and P62
Mol.Cell, 12, 2003
7TIK
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BU of 7tik by Molmil
Structure of the SARS-CoV-2 Omicron spike post-fusion bundle
Descriptor: Ferritin, Dps family protein and Spike protein S2' chimera, Spike protein S2'
Authors:Yang, K, Brunger, A.T.
Deposit date:2022-01-13
Release date:2022-04-06
Last modified:2024-06-05
Method:ELECTRON MICROSCOPY (2.4 Å)
Cite:Structure-based design of a SARS-CoV-2 Omicron-specific inhibitor.
Proc.Natl.Acad.Sci.USA, 120, 2023
8HUA
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BU of 8hua by Molmil
Serial synchrotron crystallography structure of ba3-type cytochrome c oxidase from Thermus thermophilus using a goniometer compatible flow-cell
Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, COPPER (II) ION, Cytochrome c oxidase polypeptide 2A, ...
Authors:Ghosh, S, Zoric, D, Bjelcic, M, Johannesson, J, Sandelin, E, Branden, G, Neutze, R.
Deposit date:2022-12-22
Release date:2023-03-01
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:A simple goniometer-compatible flow cell for serial synchrotron X-ray crystallography.
J.Appl.Crystallogr., 56, 2023
5J4S
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BU of 5j4s by Molmil
alpha-chymotrypsin from bovine pancreas in complex with a modified Bowman-Birk inhibitor from soybean
Descriptor: Bowman-Birk type proteinase inhibitor, Chymotrypsinogen A
Authors:Johansson, E, Tornoee, C.W.
Deposit date:2016-04-01
Release date:2017-04-12
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.103 Å)
Cite:Divergent Protein Synthesis of Bowman-Birk Protease Inhibitors, their Hydrodynamic Behavior and Co-crystallization with alpha-Chymotrypsin
Synlett, 2017
1PI2
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BU of 1pi2 by Molmil
REACTIVE SITES OF AN ANTICARCINOGENIC BOWMAN-BIRK PROTEINASE INHIBITOR ARE SIMILAR TO OTHER TRYPSIN INHIBITORS
Descriptor: BOWMAN-BIRK INHIBITOR (PI-II)
Authors:Chen, P, Rose, J, Wang, B.C.
Deposit date:1991-03-26
Release date:1992-04-15
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Reactive sites of an anticarcinogenic Bowman-Birk proteinase inhibitor are similar to other trypsin inhibitors.
J.Biol.Chem., 267, 1992
3BND
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BU of 3bnd by Molmil
Lipoxygenase-1 (Soybean), I553V Mutant
Descriptor: FE (III) ION, Seed lipoxygenase-1
Authors:Tomchick, D.R.
Deposit date:2007-12-14
Release date:2008-04-01
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Enzyme structure and dynamics affect hydrogen tunneling: the impact of a remote side chain (I553) in soybean lipoxygenase-1.
Proc.Natl.Acad.Sci.Usa, 105, 2008
3BNE
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BU of 3bne by Molmil
Lipoxygenase-1 (Soybean) I553A Mutant
Descriptor: FE (III) ION, Seed lipoxygenase-1
Authors:Tomchick, D.R.
Deposit date:2007-12-14
Release date:2008-04-01
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Enzyme structure and dynamics affect hydrogen tunneling: the impact of a remote side chain (I553) in soybean lipoxygenase-1.
Proc.Natl.Acad.Sci.Usa, 105, 2008
2K7H
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BU of 2k7h by Molmil
NMR solution structure of soybean allergen Gly m 4
Descriptor: Stress-induced protein SAM22
Authors:Berkner, H, Neudecker, P, Mittag, D, Ballmer-Weber, B.K, Schweimer, K, Vieths, S, Roesch, P.
Deposit date:2008-08-11
Release date:2009-05-05
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Cross-reactivity of pollen and food allergens: soybean Gly m 4 is a member of the Bet v 1 superfamily and closely resembles yellow lupine proteins
Biosci.Rep., 29, 2009
2KN2
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BU of 2kn2 by Molmil
Solution structure of the C-terminal domain of soybean calmodulin isoform 4 fused with the calmodulin-binding domain of NtMKP1
Descriptor: CALCIUM ION, Calmodulin
Authors:Ishida, H, Rainaldi, M, Vogel, H.J.
Deposit date:2009-08-12
Release date:2009-08-25
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Structural studies of soybean calmodulin isoform 4 bound to the calmodulin-binding domain of tobacco mitogen-activated protein kinase phosphatase-1 provide insights into a sequential target binding mode.
J.Biol.Chem., 284, 2009
2KSZ
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BU of 2ksz by Molmil
The solution structure of the Magnesium bound soybean calmodulin isoform 4 N-domain
Descriptor: MAGNESIUM ION, Putative uncharacterized protein
Authors:Huang, H, Ishida, H, Vogel, H.J.
Deposit date:2010-01-14
Release date:2010-03-09
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:The solution structure of the Mg2+ form of soybean calmodulin isoform 4 reveals unique features of plant calmodulins in resting cells.
Protein Sci., 19, 2010
7S10
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BU of 7s10 by Molmil
Crystal Structure of ascorbate peroxidase triple mutant: S160M, L203M, Q204M
Descriptor: L-ascorbate peroxidase, POTASSIUM ION, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Poulos, T.L, Kim, J, Murarka, V.
Deposit date:2021-08-31
Release date:2022-09-07
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.40000689 Å)
Cite:Computational analysis of the tryptophan cation radical energetics in peroxidase Compound I.
J.Biol.Inorg.Chem., 27, 2022
1AVX
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BU of 1avx by Molmil
COMPLEX PORCINE PANCREATIC TRYPSIN/SOYBEAN TRYPSIN INHIBITOR, TETRAGONAL CRYSTAL FORM
Descriptor: CALCIUM ION, TRYPSIN, TRYPSIN INHIBITOR
Authors:Song, H.K, Suh, S.W.
Deposit date:1997-09-21
Release date:1998-10-28
Last modified:2023-08-02
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Kunitz-type soybean trypsin inhibitor revisited: refined structure of its complex with porcine trypsin reveals an insight into the interaction between a homologous inhibitor from Erythrina caffra and tissue-type plasminogen activator.
J.Mol.Biol., 275, 1998

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