6BYN
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![BU of 6byn by Molmil](/molmil-images/mine/6byn) | Crystal structure of WDR5-Mb(S4) monobody complex | Descriptor: | WD repeat-containing protein 5, WDR5-binding Monobody, Mb(S4) | Authors: | Gupta, A, Koide, S. | Deposit date: | 2017-12-21 | Release date: | 2018-07-04 | Last modified: | 2023-10-04 | Method: | X-RAY DIFFRACTION (2.69 Å) | Cite: | Facile target validation in an animal model with intracellularly expressed monobodies. Nat. Chem. Biol., 14, 2018
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7US2
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![BU of 7us2 by Molmil](/molmil-images/mine/7us2) | PARL-cleaved Skd3 (human ClpB) E455Q Nucleotide Binding Domain hexamer bound to ATPgammaS, open conformation | Descriptor: | Caseinolytic peptidase B protein homolog, MAGNESIUM ION, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, ... | Authors: | Gupta, A, Lentzsch, A.M, Siegel, A.S, Yu, Z, Lu, C, Chio, U.S, Cheng, Y, Shan, S.-o. | Deposit date: | 2022-04-22 | Release date: | 2023-04-26 | Last modified: | 2023-11-08 | Method: | ELECTRON MICROSCOPY (2.76 Å) | Cite: | Dodecamer assembly of a metazoan AAA + chaperone couples substrate extraction to refolding. Sci Adv, 9, 2023
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5H16
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![BU of 5h16 by Molmil](/molmil-images/mine/5h16) | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with citrate at 2.3 A resolution. | Descriptor: | CITRIC ACID, Phosphopantetheine adenylyltransferase | Authors: | Gupta, A, Singh, P.K, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2016-10-08 | Release date: | 2016-11-09 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii at 2.3 A resolution. To Be Published
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4Y55
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![BU of 4y55 by Molmil](/molmil-images/mine/4y55) | Crystal structure of Buffalo lactoperoxidase with Rhodanide at 2.09 Angstrom resolution | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, IODIDE ION, ... | Authors: | Gupta, A, Tyagi, T.K, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2015-02-11 | Release date: | 2015-03-25 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (2.1 Å) | Cite: | Crystal structure of Buffalo lactoperoxidase with Rhodanide at 2.09 Angstrom resolution To Be Published
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5ZZC
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![BU of 5zzc by Molmil](/molmil-images/mine/5zzc) | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Dephospho Coenzyme A at 1.94A resolution | Descriptor: | CHLORIDE ION, DEPHOSPHO COENZYME A, MAGNESIUM ION, ... | Authors: | Gupta, A, Singh, P.K, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2018-05-31 | Release date: | 2018-06-13 | Last modified: | 2023-11-22 | Method: | X-RAY DIFFRACTION (1.96 Å) | Cite: | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Dephospho Coenzyme A at 1.94 A resolution To Be Published
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1I9G
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![BU of 1i9g by Molmil](/molmil-images/mine/1i9g) | CRYSTAL STRUCTURE OF AN ADOMET DEPENDENT METHYLTRANSFERASE | Descriptor: | HYPOTHETICAL PROTEIN RV2118C, S-ADENOSYLMETHIONINE | Authors: | Gupta, A, Kumar, P.H, Dineshkumar, T.K, Varshney, U, Subramanya, H.S, TB Structural Genomics Consortium (TBSGC) | Deposit date: | 2001-03-20 | Release date: | 2001-09-26 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (1.98 Å) | Cite: | Crystal structure of Rv2118c: an AdoMet-dependent methyltransferase from Mycobacterium tuberculosis H37Rv. J.Mol.Biol., 312, 2001
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5YH7
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![BU of 5yh7 by Molmil](/molmil-images/mine/5yh7) | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Coenzyme A at 2.0 A resolution | Descriptor: | COENZYME A, Phosphopantetheine adenylyltransferase, SULFATE ION | Authors: | Singh, P.K, Gupta, A, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2017-09-27 | Release date: | 2017-10-11 | Last modified: | 2023-11-22 | Method: | X-RAY DIFFRACTION (2.03 Å) | Cite: | Structural and binding studies of phosphopantetheine adenylyl transferase from Acinetobacter baumannii. Biochim Biophys Acta Proteins Proteom, 1867, 2019
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5H7X
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![BU of 5h7x by Molmil](/molmil-images/mine/5h7x) | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with 2-hydroxy-1,2,3-propane tricarboxylate at 1.76 A resolution | Descriptor: | CITRIC ACID, Phosphopantetheine adenylyltransferase | Authors: | Singh, P.K, Gupta, A, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2016-11-21 | Release date: | 2016-12-07 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.76 Å) | Cite: | Structural and binding studies of phosphopantetheine adenylyl transferase from Acinetobacter baumannii. Biochim Biophys Acta Proteins Proteom, 1867, 2019
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8F8V
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![BU of 8f8v by Molmil](/molmil-images/mine/8f8v) | Crystal structure of Nb.X0 | Descriptor: | Nb.X0 | Authors: | Goldgur, Y, Ravetch, J, Gupta, A, Kao, K, Andi, B. | Deposit date: | 2022-11-22 | Release date: | 2023-03-29 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (1.81 Å) | Cite: | Mechanism of glycoform specificity and in vivo protection by an anti-afucosylated IgG nanobody. Nat Commun, 14, 2023
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8F8X
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![BU of 8f8x by Molmil](/molmil-images/mine/8f8x) | Crystal structure of Nb.X0 bound to the afucosylated human IgG1 fragment crystal form II | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Nb.X0, Uncharacterized protein DKFZp686C11235 | Authors: | Goldgur, Y, Ravetch, J, Gupta, A, Kao, K, Oren, D. | Deposit date: | 2022-11-22 | Release date: | 2023-03-29 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (2.6 Å) | Cite: | Mechanism of glycoform specificity and in vivo protection by an anti-afucosylated IgG nanobody. Nat Commun, 14, 2023
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8F8W
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![BU of 8f8w by Molmil](/molmil-images/mine/8f8w) | Crystal structure of Nb.X0 bound to the afucosylated human IgG1 fragment crystal form I | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Nb.X0, afucosylated IgG1 fragment | Authors: | Goldgur, Y, Ravetch, J, Gupta, A, Kao, K, Oren, D. | Deposit date: | 2022-11-22 | Release date: | 2023-03-29 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (2.71 Å) | Cite: | Mechanism of glycoform specificity and in vivo protection by an anti-afucosylated IgG nanobody. Nat Commun, 14, 2023
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2Q8A
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![BU of 2q8a by Molmil](/molmil-images/mine/2q8a) | Structure of the malaria antigen AMA1 in complex with a growth-inhibitory antibody | Descriptor: | 1F9 heavy chain, 1F9 light chain, Apical membrane antigen 1 | Authors: | Gupta, A, Murphy, V.J, Anders, R.F, Batchelor, A.H. | Deposit date: | 2007-06-10 | Release date: | 2007-10-09 | Last modified: | 2023-08-30 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | Structure of the malaria antigen AMA1 in complex with a growth-inhibitory antibody. PLoS Pathog., 3, 2007
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2Q8B
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![BU of 2q8b by Molmil](/molmil-images/mine/2q8b) | Structure of the malaria antigen AMA1 in complex with a growth-inhibitory antibody | Descriptor: | 1F9 heavy chain, 1F9 light chain, Apical membrane antigen 1 | Authors: | Gupta, A, Murphy, V.J, Anders, R.F, Batchelor, A.H. | Deposit date: | 2007-06-10 | Release date: | 2007-10-09 | Last modified: | 2023-08-30 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Structure of the Malaria Antigen AMA1 in Complex with a Growth-Inhibitory Antibody Plos Pathog., 3, 2007
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5ECJ
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![BU of 5ecj by Molmil](/molmil-images/mine/5ecj) | |
4FXX
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![BU of 4fxx by Molmil](/molmil-images/mine/4fxx) | Structure of SF1 coiled-coil domain | Descriptor: | IMIDAZOLE, MALONATE ION, Splicing factor 1 | Authors: | Gupta, A, Bauer, W.J, Wang, W, Kielkopf, C.L. | Deposit date: | 2012-07-03 | Release date: | 2013-01-16 | Last modified: | 2024-02-28 | Method: | X-RAY DIFFRACTION (2.4801 Å) | Cite: | Structure of Phosphorylated SF1 Bound to U2AF(65) in an Essential Splicing Factor Complex. Structure, 21, 2013
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4GY4
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![BU of 4gy4 by Molmil](/molmil-images/mine/4gy4) | Role of the biradical intermediate observed during the turnover of SLAC: A two-domain laccase from Streptomyces coelicolor | Descriptor: | COPPER (II) ION, OXYGEN ATOM, Putative copper oxidase, ... | Authors: | Nederlof, I, Gupta, A, Canters, G.W. | Deposit date: | 2012-09-05 | Release date: | 2012-09-19 | Last modified: | 2024-03-20 | Method: | X-RAY DIFFRACTION (2.67 Å) | Cite: | Involvement of Tyr108 in the enzyme mechanism of the small laccase from Streptomyces coelicolor J.Am.Chem.Soc., 134, 2012
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4GXF
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![BU of 4gxf by Molmil](/molmil-images/mine/4gxf) | Role of the biradical intermediate observed during the turnover of SLAC: A two-domain laccase from Streptomyces coelicolor | Descriptor: | COPPER (II) ION, OXYGEN ATOM, Putative copper oxidase, ... | Authors: | Nederlof, I, Gupta, A, Canters, G.W. | Deposit date: | 2012-09-04 | Release date: | 2012-09-19 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (2.734 Å) | Cite: | Involvement of Tyr108 in the enzyme mechanism of the small laccase from Streptomyces coelicolor J.Am.Chem.Soc., 134, 2012
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8I8P
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![BU of 8i8p by Molmil](/molmil-images/mine/8i8p) | Crystal structure of the complex of phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Dephosphocoenzyme-A at 2.19 A resolution. | Descriptor: | CHLORIDE ION, DEPHOSPHO COENZYME A, MAGNESIUM ION, ... | Authors: | Ahmad, N, Viswanathan, V, Gupta, A, Sharma, P, Sharma, S, Singh, T.P. | Deposit date: | 2023-02-04 | Release date: | 2023-04-12 | Last modified: | 2024-05-29 | Method: | X-RAY DIFFRACTION (2.19 Å) | Cite: | Crystal structure of the complex of phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Dephosphocoenzyme-A at 2.19 A resolution. To Be Published
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1Z0M
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![BU of 1z0m by Molmil](/molmil-images/mine/1z0m) | the glycogen-binding domain of the AMP-activated protein kinase beta1 subunit | Descriptor: | 5'-AMP-activated protein kinase, beta-1 subunit, Cycloheptakis-(1-4)-(alpha-D-glucopyranose) | Authors: | Polekhina, G, Gupta, A, van Denderen, B.J, Feil, S.C, Kemp, B.E, Stapleton, D, Parker, M.W. | Deposit date: | 2005-03-02 | Release date: | 2005-10-25 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (1.91 Å) | Cite: | Structural Basis for Glycogen Recognition by AMP-Activated Protein Kinase. Structure, 13, 2005
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1Z0N
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![BU of 1z0n by Molmil](/molmil-images/mine/1z0n) | the glycogen-binding domain of the AMP-activated protein kinase | Descriptor: | 5'-AMP-activated protein kinase, beta-1 subunit, Cycloheptakis-(1-4)-(alpha-D-glucopyranose) | Authors: | Polekhina, G, Gupta, A, van Denderen, B.J, Feil, S.C, Kemp, B.E, Stapleton, D, Parker, M.W. | Deposit date: | 2005-03-02 | Release date: | 2005-10-25 | Last modified: | 2021-11-10 | Method: | X-RAY DIFFRACTION (1.49 Å) | Cite: | Structural Basis for Glycogen Recognition by AMP-Activated Protein Kinase. Structure, 13, 2005
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5YRR
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![BU of 5yrr by Molmil](/molmil-images/mine/5yrr) | The crystal structure of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Coenzyme A at 2.88 A resolution | Descriptor: | COENZYME A, Phosphopantetheine adenylyltransferase, SULFATE ION | Authors: | Bairagya, H.R, Gupta, A, Iqbal, N, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2017-11-09 | Release date: | 2017-11-22 | Last modified: | 2023-11-22 | Method: | X-RAY DIFFRACTION (2.88 Å) | Cite: | The crystal structure of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Coenzyme A at 2.88 A resolution To Be Published
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5Z1M
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![BU of 5z1m by Molmil](/molmil-images/mine/5z1m) | Crystal structure of the complex of trimeric Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with citrate ion at 1.87 A resolution | Descriptor: | CITRIC ACID, Phosphopantetheine adenylyltransferase | Authors: | Singh, P.K, Gupta, A, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2017-12-26 | Release date: | 2018-02-14 | Last modified: | 2023-11-22 | Method: | X-RAY DIFFRACTION (1.87 Å) | Cite: | Crystal structure of the complex of trimeric Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with citrate ion at 1.87 A resolution To Be Published
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6KKW
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![BU of 6kkw by Molmil](/molmil-images/mine/6kkw) | |
1Z40
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![BU of 1z40 by Molmil](/molmil-images/mine/1z40) | AMA1 from Plasmodium falciparum | Descriptor: | CHLORIDE ION, apical membrane antigen 1 precursor | Authors: | Bai, T, Becker, M, Gupta, A, Strike, P, Murphy, V.J, Anders, R.F, Batchelor, A.H. | Deposit date: | 2005-03-14 | Release date: | 2005-08-16 | Last modified: | 2018-02-14 | Method: | X-RAY DIFFRACTION (1.901 Å) | Cite: | Structure of AMA1 from Plasmodium falciparum reveals a clustering of polymorphisms that surround a conserved hydrophobic pocket Proc.Natl.Acad.Sci.Usa, 102, 2005
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6A75
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![BU of 6a75 by Molmil](/molmil-images/mine/6a75) | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Dephospho Coenzyme A at 2.75 A resolution | Descriptor: | CHLORIDE ION, DEPHOSPHO COENZYME A, MAGNESIUM ION, ... | Authors: | Singh, P.K, Gupta, A, Kaur, P, Sharma, S, Singh, T.P. | Deposit date: | 2018-07-02 | Release date: | 2018-07-18 | Last modified: | 2023-11-22 | Method: | X-RAY DIFFRACTION (2.75 Å) | Cite: | Crystal structure of the complex of Phosphopantetheine adenylyltransferase from Acinetobacter baumannii with Dephospho Coenzyme A at 2.75 A resolution To Be Published
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