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7C0O
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BU of 7c0o by Molmil
Crystal structure of a dinucleotide-binding protein (Y56F) of ABC transporter endogenously bound to uridylyl-3'-5'-phospho-guanosine
Descriptor: 1,2-ETHANEDIOL, CARBON DIOXIDE, CARBONATE ION, ...
Authors:Kanaujia, S.P, Chandravanshi, M, Samanta, R.
Deposit date:2020-05-01
Release date:2021-03-10
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and thermodynamic insights into the novel dinucleotide-binding protein of ABC transporter unveils its moonlighting function.
Febs J., 288, 2021
3BMX
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BU of 3bmx by Molmil
Beta-N-hexosaminidase (YbbD) from Bacillus subtilis
Descriptor: 1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE, ACETATE ION, SODIUM ION, ...
Authors:Fischer, S.
Deposit date:2007-12-13
Release date:2008-12-16
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Structural and kinetic analysis of Bacillus subtilis N-acetylglucosaminidase reveals a unique Asp-His dyad mechanism
J.Biol.Chem., 285, 2010
4BLW
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BU of 4blw by Molmil
Crystal structure of Escherichia coli 23S rRNA (A2030-N6)- methyltransferase RlmJ in complex with S-adenosylhomocysteine (AdoHcy) and Adenosine monophosphate (AMP)
Descriptor: 1,2-ETHANEDIOL, ADENOSINE MONOPHOSPHATE, GLYCEROL, ...
Authors:Punekar, A.S, Liljeruhm, J, Shepherd, T.R, Forster, A.C, Selmer, M.
Deposit date:2013-05-04
Release date:2013-08-21
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural and Functional Insights Into the Molecular Mechanism of Rrna M6A Methyltransferase Rlmj.
Nucleic Acids Res., 41, 2013
4BQP
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BU of 4bqp by Molmil
Mtb InhA complex with Methyl-thiazole compound 7
Descriptor: (1S)-1-(5-{[1-(2,6-DIFLUOROBENZYL)-1H-PYRAZOL-3-YL]AMINO}-1,3,4-THIADIAZOL-2-YL)-1-(4-METHYL-1,3-THIAZOL-2-YL)ETHANOL, ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
Authors:Read, J.A, Gingell, H, Madhavapeddi, P, Shirude, P.S.
Deposit date:2013-05-31
Release date:2013-12-11
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Methyl-Thiazoles: A Novel Mode of Inhibition with the Potential to Develop Novel Inhibitors Targeting Inha in Mycobacterium Tuberculosis.
J.Med.Chem., 56, 2013
7C0W
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BU of 7c0w by Molmil
Crystal structure of a dinucleotide-binding protein (Y224A) of ABC transporter endogenously bound to uridylyl-3'-5'-phospho-guanosine (Form II)
Descriptor: 1,2-ETHANEDIOL, CARBON DIOXIDE, GLYCEROL, ...
Authors:Kanaujia, S.P, Chandravanshi, M, Samanta, R.
Deposit date:2020-05-01
Release date:2021-03-10
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural and thermodynamic insights into the novel dinucleotide-binding protein of ABC transporter unveils its moonlighting function.
Febs J., 288, 2021
4BYM
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BU of 4bym by Molmil
Structure of PhaZ7 PHB depolymerase Y105E mutant
Descriptor: CHLORIDE ION, PHB DEPOLYMERASE PHAZ7, SODIUM ION
Authors:Hermawan, S, Subedi, B, Papageorgiou, A.C, Jendrossek, D.
Deposit date:2013-07-20
Release date:2013-09-18
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.598 Å)
Cite:Biochemical Analysis and Structure Determination of Paucimonas Lemoignei Poly(3-Hydroxybutyrate) (Phb) Depolymerase Phaz7 Muteins Reveal the Phb Binding Site and Details of Substrate-Enzyme Interactions.
Mol.Microbiol., 90, 2013
3FW5
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BU of 3fw5 by Molmil
Crystal structure of Siderocalin (NGAL, Lipocalin 2) complexed with Ferric 4-methyl-catechol
Descriptor: 4-METHYLCATECHOL, CHLORIDE ION, FE (III) ION, ...
Authors:Clifton, M.C, Strong, R.K.
Deposit date:2009-01-16
Release date:2010-05-05
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Iron traffics in circulation bound to a siderocalin (Ngal)-catechol complex.
Nat.Chem.Biol., 6, 2010
2POD
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BU of 2pod by Molmil
Crystal structure of a member of enolase superfamily from Burkholderia pseudomallei K96243
Descriptor: Mandelate racemase / muconate lactonizing enzyme, SODIUM ION
Authors:Patskovsky, Y, Bonanno, J, Sauder, J.M, Gilmore, J.M, Iizuka, M, Ozyurt, S, Wasserman, S.R, Smith, D, Gerlt, J, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2007-04-26
Release date:2007-06-05
Last modified:2021-02-03
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:Crystal Structure of a Member of Enolase Superfamily from Burkholderia Pseudomallei.
To be Published
5KBN
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BU of 5kbn by Molmil
The crystal structure of fluoride channel Fluc Ec2 F80I Mutant
Descriptor: DECYL-BETA-D-MALTOPYRANOSIDE, FLUORIDE ION, Putative fluoride ion transporter CrcB, ...
Authors:Last, N.B, Kolmakova-Partensky, L, Shane, T, Miller, C.
Deposit date:2016-06-03
Release date:2016-08-03
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.48 Å)
Cite:Mechanistic signs of double-barreled structure in a fluoride ion channel.
Elife, 5, 2016
7BUH
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BU of 7buh by Molmil
Reduced ferredoxin of carbazole 1,9a-dioxygenase
Descriptor: 1,2-ETHANEDIOL, FE2/S2 (INORGANIC) CLUSTER, Ferredoxin CarAc, ...
Authors:Matsuzawa, J, Wang, Y.X, Suzuki-Minakuchi, C, Nojiri, H.
Deposit date:2020-04-06
Release date:2021-04-07
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Reduced ferredoxin of carbazole 1,9a-dioxygenase
To Be Published
7BVW
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BU of 7bvw by Molmil
Crystal structure of the RING-H2 domain of Arabidopsis RMR1
Descriptor: AT5G66160 protein, SODIUM ION, ZINC ION
Authors:Chen, S, Wong, K.B.
Deposit date:2020-04-12
Release date:2021-04-14
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The RING-finger of AtRMR1 (Arabidopsis receptor-homology-transmembrane-RING-H2 sorting receptor 1) is an E3 ligase that mediate its trafficking
To Be Published
5HKY
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BU of 5hky by Molmil
Crystal structure of c-Cbl TKBD domain in complex with SPRY2 peptide (36-60, pY55) Refined to 1.8A Resolution (P6 form)
Descriptor: CHLORIDE ION, E3 ubiquitin-protein ligase CBL, PENTAETHYLENE GLYCOL, ...
Authors:Lovell, S, Battaile, K.P, Mehzabeen, N, Zhang, N, Cooper, A, Gao, P, Perez, R.P.
Deposit date:2016-01-14
Release date:2017-01-18
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of c-Cbl TKBD domain in complex with SPRY2 peptide (36-60, pY55) Refined to 1.8A Resolution (P6 form)
To be published
4C79
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BU of 4c79 by Molmil
Crystal structure of the Smoothened CRD, native
Descriptor: SMOOTHENED, SODIUM ION, ZINC ION
Authors:Nachtergaele, S, Whalen, D.M, Mydock, L.K, Zhao, Z, Malinauskas, T, Krishnan, K, Ingham, P.W, Covey, D.F, Rohatgi, R, Siebold, C.
Deposit date:2013-09-20
Release date:2013-11-06
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.604 Å)
Cite:Structure and Function of the Smoothened Extracellular Domain in Vertebrate Hedgehog Signaling
Elife, 2, 2013
5HBQ
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BU of 5hbq by Molmil
C63D mutant of the rhodanese domain of YgaP
Descriptor: CHLORIDE ION, Inner membrane protein YgaP, SODIUM ION
Authors:Eichmann, C, Tzitzilonis, C, Nakamura, T, Kwiatkowski, W, Maslennikov, I, Choe, S, Lipton, S.A, Riek, R.
Deposit date:2016-01-02
Release date:2016-08-10
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:S-Nitrosylation Induces Structural and Dynamical Changes in a Rhodanese Family Protein.
J.Mol.Biol., 428, 2016
4EN4
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BU of 4en4 by Molmil
Crystal Structure of the Ternary Human PL Kinase-Ginkgotoxin-MgATP Complex
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 5-(hydroxymethyl)-4-(methoxymethyl)-2-methylpyridin-3-ol, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Safo, M.K, Musayev, F.N, Gandhi, A.K.
Deposit date:2012-04-12
Release date:2012-05-02
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Crystal structures of human pyridoxal kinase in complex with the neurotoxins, ginkgotoxin and theophylline: insights into pyridoxal kinase inhibition.
Plos One, 7, 2012
5HDG
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BU of 5hdg by Molmil
crystal structure of heat shock factor 1-DBD
Descriptor: Heat shock factor protein 1, SODIUM ION
Authors:Feng, H, Liu, W, Wang, D.C.
Deposit date:2016-01-05
Release date:2017-01-11
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:HSF1-DBD crystal structure
To Be Published
1R4P
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BU of 1r4p by Molmil
Shiga toxin type 2
Descriptor: 1,2-ETHANEDIOL, 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE, FORMIC ACID, ...
Authors:Fraser, M.E, Fujinaga, M, Cherney, M.M, Melton-Celsa, A.R, Twiddy, E.M, O'Brien, A.D, James, M.N.G.
Deposit date:2003-10-07
Release date:2004-05-11
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Structure of Shiga Toxin Type 2 (Stx2) from Escherichia coli O157:H7.
J.Biol.Chem., 279, 2004
4E41
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BU of 4e41 by Molmil
Structural basis for the recognition of mutant self by a tumor-specific, MHC class II-restricted T cell receptor G4
Descriptor: HLA class II histocompatibility antigen, DR alpha chain, DRB1-1 beta chain, ...
Authors:Deng, L, Langley, R.J, Wang, Q, Topalian, S.L, Mariuzza, R.A.
Deposit date:2012-03-11
Release date:2012-08-29
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural basis for the recognition of mutant self by a tumor-specific, MHC class II-restricted T cell receptor G4
Proc.Natl.Acad.Sci.USA, 2012
1OB0
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BU of 1ob0 by Molmil
Kinetic stabilization of Bacillus licheniformis alpha-amylase through introduction of hydrophobic residues at the surface
Descriptor: ALPHA-AMYLASE, CALCIUM ION, SODIUM ION
Authors:Machius, M, Declerck, N, Huber, R, Wiegand, G.
Deposit date:2003-01-21
Release date:2003-01-30
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Kinetic Stabilization of Bacillus Licheniformis Alpha-Amylase Through Introduction of Hydrophobic Residues at the Surface
J.Biol.Chem., 278, 2003
2OKQ
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BU of 2okq by Molmil
Crystal structure of unknown conserved ybaA protein from Shigella flexneri
Descriptor: Hypothetical protein ybaA, SODIUM ION
Authors:Minasov, G, Vorontsov, I.I, Shuvalova, L, Brunzelle, J.S, Kiryukhina, O, Collart, F.R, Joachimiak, A, Anderson, W.F, Midwest Center for Structural Genomics (MCSG)
Deposit date:2007-01-17
Release date:2007-02-06
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of unknown conserved ybaA protein from Shigella flexneri
TO BE PUBLISHED
3B6P
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BU of 3b6p by Molmil
Structure of TREX1 in complex with a nucleotide and inhibitor ions (sodium and zinc)
Descriptor: SODIUM ION, THYMIDINE-5'-PHOSPHATE, Three prime repair exonuclease 1, ...
Authors:Brucet, M, Querol-Audi, J, Fita, I, Celada, A.
Deposit date:2007-10-29
Release date:2008-09-23
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural and biochemical studies of TREX1 inhibition by metals. Identification of a new active histidine conserved in DEDDh exonucleases.
Protein Sci., 17, 2008
4EAE
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BU of 4eae by Molmil
The crystal structure of a functionally unknown protein from Listeria monocytogenes EGD-e
Descriptor: D-MALATE, Lmo1068 protein, SODIUM ION
Authors:Tan, K, Zhou, M, Kwon, K, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2012-03-22
Release date:2012-04-04
Method:X-RAY DIFFRACTION (1.32 Å)
Cite:The crystal structure of a functionally unknown protein from Listeria monocytogenes EGD-e
To be Published
5HZR
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BU of 5hzr by Molmil
Crystal structure of MtSnf2
Descriptor: 3-(1-methylpiperidinium-1-yl)propane-1-sulfonate, SNF2-family ATP dependent chromatin remodeling factor like protein, SODIUM ION, ...
Authors:Chen, Z.C, Xia, X.
Deposit date:2016-02-02
Release date:2016-07-20
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.33 Å)
Cite:Structure of chromatin remodeler Swi2/Snf2 in the resting state
Nat.Struct.Mol.Biol., 23, 2016
1XLT
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BU of 1xlt by Molmil
Crystal structure of Transhydrogenase [(domain I)2:domain III] heterotrimer complex
Descriptor: NAD(P) transhydrogenase subunit alpha part 1, NAD(P) transhydrogenase subunit beta, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Sundaresan, V, Chartron, J, Yamaguchi, M, Stout, C.D.
Deposit date:2004-09-30
Release date:2005-04-05
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Conformational Diversity in NAD(H) and Transhydrogenase Nicotinamide Nucleotide Binding Domains
J.Mol.Biol., 346, 2005
5JWG
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BU of 5jwg by Molmil
Crystal structure of Porphyromonas endodontalis DPP11 in complex with dipeptide Arg-Asp
Descriptor: 1,2-ETHANEDIOL, ARGININE, ASPARTIC ACID, ...
Authors:Bezerra, G.A, Fedosyuk, S, Ohara-Nemoto, Y, Nemoto, T.K, Djinovic-Carugo, K.
Deposit date:2016-05-12
Release date:2017-06-14
Last modified:2017-06-21
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Bacterial protease uses distinct thermodynamic signatures for substrate recognition.
Sci Rep, 7, 2017

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