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PDB: 166 results

5EZ8
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BU of 5ez8 by Molmil
A de novo designed heptameric coiled coil CC-Hept-I-C-I
Descriptor: CC-Hept-I-C-I
Authors:Burton, A.J, Brady, R.L, Woolfson, D.N.
Deposit date:2015-11-26
Release date:2016-07-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Installing hydrolytic activity into a completely de novo protein framework.
Nat.Chem., 8, 2016
1T2D
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BU of 1t2d by Molmil
Plasmodium falciparum lactate dehydrogenase complexed with NAD+ and oxalate
Descriptor: GLYCEROL, L-lactate dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
Authors:Cameron, A, Read, J, Tranter, R, Winter, V.J, Sessions, R.B, Brady, R.L, Vivas, L, Easton, A, Kendrick, H, Croft, S.L, Barros, D, Lavandera, J.L, Martin, J.J, Risco, F, Garcia-Ochoa, S, Gamo, F.J, Sanz, L, Leon, L, Ruiz, J.R, Gabarro, R, Mallo, A, De Las Heras, F.G.
Deposit date:2004-04-21
Release date:2004-05-11
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Identification and Activity of a Series of Azole-based Compounds with Lactate Dehydrogenase-directed Anti-malarial Activity.
J.Biol.Chem., 279, 2004
1T2F
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BU of 1t2f by Molmil
Human B lactate dehydrogenase complexed with NAD+ and 4-hydroxy-1,2,5-oxadiazole-3-carboxylic acid
Descriptor: 4-HYDROXY-1,2,5-OXADIAZOLE-3-CARBOXYLIC ACID, L-lactate dehydrogenase B chain, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Cameron, A, Read, J, Tranter, R, Winter, V.J, Sessions, R.B, Brady, R.L, Vivas, L, Easton, A, Kendrick, H, Croft, S.L, Barros, D, Lavandera, J.L, Martin, J.J, Risco, F, Garcia-Ochoa, S, Gamo, F.J, Sanz, L, Leon, L, Ruiz, J.R, Gabarro, R, Mallo, A, De Las Heras, F.G.
Deposit date:2004-04-21
Release date:2004-05-11
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (3 Å)
Cite:Identification and Activity of a Series of Azole-based Compounds with Lactate Dehydrogenase-directed Anti-malarial Activity.
J.Biol.Chem., 279, 2004
5EZA
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BU of 5eza by Molmil
A de novo designed heptameric coiled coil CC-Hept-I18C-L22H
Descriptor: CC-Hept-C-H-I, GLYCEROL
Authors:Burton, A.J, Brady, R.L, Woolfson, D.N.
Deposit date:2015-11-26
Release date:2016-07-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Installing hydrolytic activity into a completely de novo protein framework.
Nat.Chem., 8, 2016
5EZE
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BU of 5eze by Molmil
A de novo designed heptameric coiled coil CC-Hept-I18betaMeCys-L22H-I25E
Descriptor: CC-Hept-bMeCys-His-Glu, GLYCEROL
Authors:Burton, A.J, Brady, R.L, Woolfson, D.N.
Deposit date:2015-11-26
Release date:2016-07-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Installing hydrolytic activity into a completely de novo protein framework.
Nat.Chem., 8, 2016
5EZ9
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BU of 5ez9 by Molmil
A de novo designed heptameric coiled coil CC-Hept-I-H-I
Descriptor: CC-Hept-L22H, HEXANE-1,6-DIOL
Authors:Burton, A.J, Brady, R.L, Woolfson, D.N.
Deposit date:2015-11-26
Release date:2016-07-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Installing hydrolytic activity into a completely de novo protein framework.
Nat.Chem., 8, 2016
5EZC
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BU of 5ezc by Molmil
A de novo designed heptameric coiled coil CC-Hept-I18C-L22H-I25E
Descriptor: CC-Hept-C-H-E
Authors:Burton, A.J, Brady, R.L, Woolfson, D.N.
Deposit date:2015-11-26
Release date:2016-07-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Installing hydrolytic activity into a completely de novo protein framework.
Nat.Chem., 8, 2016
5F2Y
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BU of 5f2y by Molmil
A de novo designed heptameric coiled coil CC-Hept-homoCys-H-E
Descriptor: CC-Hept-hCys-H-E
Authors:Burton, A.J, Brady, R.L, Woolfson, D.N.
Deposit date:2015-12-02
Release date:2016-07-06
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Installing hydrolytic activity into a completely de novo protein framework.
Nat.Chem., 8, 2016
1T2C
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BU of 1t2c by Molmil
Plasmodium falciparum lactate dehydrogenase complexed with NADH
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, GLYCEROL, L-lactate dehydrogenase
Authors:Cameron, A, Read, J, Tranter, R, Winter, V.J, Sessions, R.B, Brady, R.L, Vivas, L, Easton, A, Kendrick, H, Croft, S.L, Barros, D, Lavandera, J.L, Martin, J.J, Risco, F, Garcia-Ochoa, S, Gamo, F.J, Sanz, L, Leon, L, Ruiz, J.R, Gabarro, R, Mallo, A, De Las Heras, F.G.
Deposit date:2004-04-21
Release date:2004-05-11
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Identification and Activity of a Series of Azole-based Compounds with Lactate Dehydrogenase-directed Anti-malarial Activity.
J.Biol.Chem., 279, 2004
1CET
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BU of 1cet by Molmil
CHLOROQUINE BINDS IN THE COFACTOR BINDING SITE OF PLASMODIUM FALCIPARUM LACTATE DEHYDROGENASE.
Descriptor: N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE, PROTEIN (L-LACTATE DEHYDROGENASE)
Authors:Read, J.A, Wilkinson, K.W, Tranter, R, Sessions, R.B, Brady, R.L.
Deposit date:1999-03-10
Release date:1999-03-19
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Chloroquine binds in the cofactor binding site of Plasmodium falciparum lactate dehydrogenase.
J.Biol.Chem., 274, 1999
1CEQ
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BU of 1ceq by Molmil
CHLOROQUINE BINDS IN THE COFACTOR BINDING SITE OF PLASMODIUM FALCIPARUM LACTATE DEHYDROGENASE.
Descriptor: PROTEIN (L-LACTATE DEHYDROGENASE)
Authors:Read, J.A, Wilkinson, K.W, Tranter, R, Sessions, R.B, Brady, R.L.
Deposit date:1999-03-10
Release date:1999-03-19
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2 Å)
Cite:Chloroquine binds in the cofactor binding site of Plasmodium falciparum lactate dehydrogenase.
J.Biol.Chem., 274, 1999
1CLO
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BU of 1clo by Molmil
ANTI-CARCINOEMBRYONIC ANTIGEN MONOCLONAL ANTIBODY A5B7
Descriptor: A5B7 MONOCLONAL ANTIBODY
Authors:Banfield, M.J, King, D.J, Mountain, A, Brady, R.L.
Deposit date:1996-05-01
Release date:1997-05-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:VL:VH domain rotations in engineered antibodies: crystal structures of the Fab fragments from two murine antitumor antibodies and their engineered human constructs.
Proteins, 29, 1997
3R3K
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BU of 3r3k by Molmil
Crystal structure of a parallel 6-helix coiled coil
Descriptor: 1,2-ETHANEDIOL, CChex-Phi22 helix, CHLORIDE ION, ...
Authors:Zaccai, N.R, Chi, B.H.C, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-16
Release date:2011-11-16
Last modified:2011-11-30
Method:X-RAY DIFFRACTION (2.2009 Å)
Cite:A de novo peptide hexamer with a mutable channel.
Nat.Chem.Biol., 7, 2011
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
3R9B
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BU of 3r9b by Molmil
Crystal structure of Mycobacterium smegmatis CYP164A2 in ligand free state
Descriptor: 1,2-ETHANEDIOL, CYTOCHROME P450 164A2, DODECANE, ...
Authors:Agnew, C.R.J, Warrilow, A.G.S, Kelly, S.L, Brady, R.L.
Deposit date:2011-03-25
Release date:2012-04-04
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:An enlarged, adaptable active site in CYP164 family P450 enzymes, the sole P450 in Mycobacterium leprae.
Antimicrob.Agents Chemother., 56, 2012
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
3RA3
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BU of 3ra3 by Molmil
Crystal structure of a section of a de novo design gigaDalton protein fibre
Descriptor: SODIUM ION, p1c, p2f
Authors:Zaccai, N.R, Sharp, T.H, Bruning, M, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-27
Release date:2012-08-08
Last modified:2013-06-19
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Cryo-transmission electron microscopy structure of a gigadalton peptide fiber of de novo design
Proc.Natl.Acad.Sci.USA, 109, 2012
3R47
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BU of 3r47 by Molmil
Crystal structure of a 6-helix coiled coil CC-hex-H24
Descriptor: BROMIDE ION, coiled coil helix L24H
Authors:Zaccai, N.R, Chi, B.H.C, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-17
Release date:2011-11-16
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.5002 Å)
Cite:A de novo peptide hexamer with a mutable channel.
Nat.Chem.Biol., 7, 2011
3R9C
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BU of 3r9c by Molmil
Crystal structure of Mycobacterium smegmatis CYP164A2 with Econazole bound
Descriptor: 1,2-ETHANEDIOL, 1-[(2R)-2-[(4-chlorobenzyl)oxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole, Cytochrome P450 164A2, ...
Authors:Agnew, C.R.J, Kelly, S.L, Brady, R.L.
Deposit date:2011-03-25
Release date:2012-03-28
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:An enlarged, adaptable active site in CYP164 family P450 enzymes, the sole P450 in Mycobacterium leprae.
Antimicrob.Agents Chemother., 56, 2012
3R46
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BU of 3r46 by Molmil
Crystal structure of a parallel 6-helix coiled coil CC-hex-D24
Descriptor: CHLORIDE ION, GLYCEROL, SODIUM ION, ...
Authors:Zaccai, N.R, Chi, B.H.C, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-17
Release date:2011-11-16
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.751 Å)
Cite:A de novo peptide hexamer with a mutable channel.
Nat.Chem.Biol., 7, 2011
3R4A
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BU of 3r4a by Molmil
Crystal structure of the 4-helix coiled coil CC-tet
Descriptor: coiled coil helix CC-tet
Authors:Zaccai, N.R, Chi, B.H.C, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-17
Release date:2011-11-16
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.0701 Å)
Cite:A de novo peptide hexamer with a mutable channel.
Nat.Chem.Biol., 7, 2011
3R48
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BU of 3r48 by Molmil
Crystal structure of a hetero-hexamer coiled coil
Descriptor: GLYCEROL, coiled coil helix W22-L24H, coiled coil helix Y15-L24D
Authors:Zaccai, N.R, Chi, B.H.C, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-17
Release date:2011-11-16
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.0011 Å)
Cite:A de novo peptide hexamer with a mutable channel.
Nat.Chem.Biol., 7, 2011
3R4H
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BU of 3r4h by Molmil
Crystal structure of the 4-helix coiled coil CC-Tet-phi22
Descriptor: coiled coil helix CC-Tet-phi22
Authors:Zaccai, N.R, Chi, B.H.C, Woolfson, D.N, Brady, R.L.
Deposit date:2011-03-17
Release date:2011-11-16
Last modified:2019-07-17
Method:X-RAY DIFFRACTION (2.7003 Å)
Cite:A de novo peptide hexamer with a mutable channel.
Nat.Chem.Biol., 7, 2011
1EB2
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BU of 1eb2 by Molmil
Trypsin inhibitor complex (BPO)
Descriptor: 3-[(Z)-AMINO(IMINO)METHYL]-N-[2-(4-BENZOYL-1-PIPERIDINYL)-2-OXO-1-PHENYLETHYL]BENZAMIDE, CALCIUM ION, SULFATE ION, ...
Authors:Wilkinson, K.W, Young, S.C, Liebeschuetz, J.W, Brady, R.L.
Deposit date:2001-07-18
Release date:2002-02-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Pro_Select: Combining Structure-Based Drug Design and Array-Based Chemistry for Rapid Lead Discovery. 2. The Development of a Series of Highly Potent and Selective Factor Xa Inhibitors
J.Med.Chem., 45, 2002
1A7B
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BU of 1a7b by Molmil
ENGINEERING A MISFOLDED FORM OF CD2
Descriptor: CD2
Authors:Murray, A.J, Head, J.G, Barker, J.J, Brady, R.L.
Deposit date:1998-03-10
Release date:1998-06-17
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Engineering an intertwined form of CD2 for stability and assembly.
Nat.Struct.Biol., 5, 1998

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数据于2024-06-12公开中

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