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1TD7
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BU of 1td7 by Molmil
Interactions of a specific non-steroidal anti-inflammatory drug (NSAID) with group I phospholipase A2 (PLA2): Crystal structure of the complex formed between PLA2 and niflumic acid at 2.5 A resolution
Descriptor: 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID, CALCIUM ION, Phospholipase A2 isoform 3
Authors:Jabeen, T, Singh, N, Singh, R.K, Sharma, S, Perbandt, M, Betzel, C, Singh, T.P.
Deposit date:2004-05-21
Release date:2004-06-08
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Non-steroidal anti-inflammatory drugs as potent inhibitors of phospholipase A2: structure of the complex of phospholipase A2 with niflumic acid at 2.5 Angstroms resolution.
Acta Crystallogr.,Sect.D, 61, 2005
1S6B
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BU of 1s6b by Molmil
X-ray Crystal Structure of a Complex Formed Between Two Homologous Isoforms of Phospholipase A2 from Naja naja sagittifera: Principle of Molecular Association and Inactivation
Descriptor: ACETIC ACID, CALCIUM ION, PHOSPHATE ION, ...
Authors:Jabeen, T, Sharma, S, Singh, R.K, Kaur, P, Singh, T.P.
Deposit date:2004-01-23
Release date:2004-02-10
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of a calcium-induced dimer of two isoforms of cobra phospholipase A2 at 1.6 A resolution.
Proteins, 59, 2005
2X3A
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BU of 2x3a by Molmil
AsaP1 inactive mutant E294Q, an extracellular toxic zinc metalloendopeptidase
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, SULFATE ION, ...
Authors:Bogdanovic, X, Palm, G.J, Singh, R.K, Hinrichs, W.
Deposit date:2010-01-22
Release date:2011-02-02
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural Evidence of Intramolecular Propeptide Inhibition of the Aspzincin Metalloendopeptidase Asap1.
FEBS Lett., 590, 2016
2X3B
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BU of 2x3b by Molmil
AsaP1 inactive mutant E294A, an extracellular toxic zinc metalloendopeptidase
Descriptor: TOXIC EXTRACELLULAR ENDOPEPTIDASE, ZINC ION
Authors:Bogdanovic, X, Palm, G.J, Singh, R.K, Hinrichs, W.
Deposit date:2010-01-22
Release date:2011-02-02
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.28 Å)
Cite:Structural Evidence of Intramolecular Propeptide Inhibition of the Aspzincin Metalloendopeptidase Asap1.
FEBS Lett., 590, 2016
2X3C
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BU of 2x3c by Molmil
AsaP1 inactive mutant E294Q, an extracellular toxic zinc metalloendopeptidase
Descriptor: CHLORIDE ION, GLYCEROL, SULFATE ION, ...
Authors:Bogdanovic, X, Palm, G.J, Singh, R.K, Hinrichs, W.
Deposit date:2010-01-22
Release date:2011-02-02
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Structural Evidence of Intramolecular Propeptide Inhibition of the Aspzincin Metalloendopeptidase Asap1.
FEBS Lett., 590, 2016
2Y40
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BU of 2y40 by Molmil
Structure of Isopropylmalate dehydrogenase from Thermus thermophilus - complex with Mn
Descriptor: 3-ISOPROPYLMALATE DEHYDROGENASE, MANGANESE (II) ION
Authors:Graczer, E, merlin, A, Singh, R.K, Manikandan, K, Zavodsky, P, Weiss, M.S, Vas, M.
Deposit date:2011-01-04
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Atomic Level Description of the Domain Closure in a Dimeric Enzyme: Thermus Thermophilus 3-Isopropylmalate Dehydrogenase.
Mol.Biosyst., 7, 2011
2Y42
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BU of 2y42 by Molmil
Structure of Isopropylmalate dehydrogenase from Thermus thermophilus - complex with NADH and Mn
Descriptor: 3-ISOPROPYLMALATE DEHYDROGENASE, BICINE, MANGANESE (II) ION, ...
Authors:Graczer, E, merlin, A, Singh, R.K, Manikandan, K, Zavodsky, P, Weiss, M.S, Vas, M.
Deposit date:2011-01-04
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Atomic Level Description of the Domain Closure in a Dimeric Enzyme: Thermus Thermophilus 3-Isopropylmalate Dehydrogenase.
Mol.Biosyst., 7, 2011
2Y3Z
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BU of 2y3z by Molmil
Structure of Isopropylmalate dehydrogenase from Thermus thermophilus - apo enzyme
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-ISOPROPYLMALATE DEHYDROGENASE, GLYCEROL, ...
Authors:Graczer, E, merlin, A, Singh, R.K, Manikandan, K, Zavodsky, P, Weiss, M.S, Vas, M.
Deposit date:2011-01-04
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Atomic Level Description of the Domain Closure in a Dimeric Enzyme: Thermus Thermophilus 3-Isopropylmalate Dehydrogenase.
Mol.Biosyst., 7, 2011
2Y41
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BU of 2y41 by Molmil
Structure of Isopropylmalate dehydrogenase from Thermus thermophilus - complex with IPM and MN
Descriptor: 3-ISOPROPYLMALATE DEHYDROGENASE, 3-ISOPROPYLMALIC ACID, MANGANESE (II) ION
Authors:Graczer, E, merlin, A, Singh, R.K, Manikandan, K, Zavodsky, P, Weiss, M.S, Vas, M.
Deposit date:2011-01-04
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Atomic Level Description of the Domain Closure in a Dimeric Enzyme: Thermus Thermophilus 3-Isopropylmalate Dehydrogenase.
Mol.Biosyst., 7, 2011
1OWS
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BU of 1ows by Molmil
Crystal structure of a C49 Phospholipase A2 from Indian cobra reveals carbohydrate binding in the hydrophobic channel
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Phospholipase A2, ZINC ION
Authors:Jabeen, T, Jasti, J, Singh, N, Singh, R.K, Sharma, S, Kaur, P, Singh, T.P.
Deposit date:2003-03-30
Release date:2003-05-20
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of a C49 Phospholipase A2 from Indian cobra reveals carbohydrate binding in the hydrophobic channel
To be Published
1YXH
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BU of 1yxh by Molmil
Crystal structure of a novel phospholipase A2 from Naja naja sagittifera with a strong anticoagulant activity
Descriptor: CALCIUM ION, ETHANOL, PHOSPHATE ION, ...
Authors:Jabeen, T, Singh, N, Singh, R.K, Sharma, S, Srinivasan, A, Singh, T.P.
Deposit date:2005-02-21
Release date:2005-05-03
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Crystal structure of a novel phospholipase A(2) from Naja naja sagittifera with a strong anticoagulant activity
Toxicon, 46, 2005
1XXW
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BU of 1xxw by Molmil
Structure of zinc induced heterodimer of two calcium free isoforms of phospholipase A2 from Naja naja sagittifera at 2.7A resolution
Descriptor: ACETIC ACID, Phospholipase A2 isoform 1, Phospholipase A2 isoform 2, ...
Authors:Jabeen, T, Sharma, S, Singh, N, Singh, R.K, Verma, A.K, Paramasivam, M, Srinivasan, A, Singh, T.P.
Deposit date:2004-11-09
Release date:2005-03-15
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure of the zinc-induced heterodimer of two calcium-free isoforms of phospholipase A2 from Naja naja sagittifera at 2.7 angstroms resolution.
Acta Crystallogr.,Sect.D, 61, 2005
1Y75
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BU of 1y75 by Molmil
A new form of catalytically inactive phospholipase A2 with an unusual disulphide bridge Cys 32- Cys 49 reveals recognition for N-acetylglucosmine
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, ZINC ION, phospholipase A2 isoform 5, ...
Authors:Jabeen, T, Singh, N, Jasti, J, Singh, R.K, Sharma, S, Perbandt, M, Betzel, C, Kaur, P, Srinivasan, A, Singh, T.P.
Deposit date:2004-12-08
Release date:2005-05-03
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of a heterodimer of phospholipase A2 from Naja naja sagittifera at 2.3 A resolution reveals the presence of a new PLA2-like protein with a novel cys 32-Cys 49 disulphide bridge with a bound sugar at the substrate-binding site
Proteins, 62, 2006
1MH2
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BU of 1mh2 by Molmil
Crystal Structure of a Zinc Containing Dimer of Phospholipase A2 from the Venom of Indian Cobra (Naja Naja Sagittifera)
Descriptor: ACETIC ACID, PHOSPHOLIPASE A2, ZINC ION
Authors:Jabeen, T, Varma, A.K, Paramasivam, M, Singh, N, Singh, R.K, Sharma, S, Srinivasan, A, Singh, T.P.
Deposit date:2002-08-19
Release date:2003-05-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystal Structure of a Zinc Containing Dimer of Phospholipase A2 from the Venom of Indian cobra (Naja Naja Saggittifera)
To be Published
1MH8
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BU of 1mh8 by Molmil
Crystal Structure of a Phopholipase A2 Monomer with Isoleucine at Second Position
Descriptor: PHOSPHOLIPASE A2
Authors:Jabeen, T, Jasti, J, Singh, N, Singh, R.K, Sharma, S, Singh, T.P.
Deposit date:2002-08-19
Release date:2003-06-10
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Crystal Structure of a Phospholipase A2 Monomer with Isoleucine at Second Position
To be Published
5M04
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BU of 5m04 by Molmil
Structure of ObgE from Escherichia coli
Descriptor: GTPase ObgE/CgtA, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION
Authors:Gkekas, S, Singh, R.K, Versees, W.
Deposit date:2016-10-03
Release date:2017-03-01
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structural and biochemical analysis of Escherichia coli ObgE, a central regulator of bacterial persistence.
J. Biol. Chem., 292, 2017
1MH7
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BU of 1mh7 by Molmil
Crystal Structure of a Calcium-Free Isoform of Phospholipase A2 from Naja naja sagittifera at 2.0 A Resolution
Descriptor: PHOSPHOLIPASE A2
Authors:Jabeen, T, Jasti, J, Singh, R.K, Sujata, S, Singh, T.P.
Deposit date:2002-08-19
Release date:2003-05-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structure of a Calcium-Free Isoform of Phospholipase A2 from Naja naja sagittifera at 2.0 A Resolution
To be Published
7PU1
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BU of 7pu1 by Molmil
High resolution X-ray structure of Thermoascus aurantiacus LPMO
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, COPPER (II) ION, ...
Authors:Banerjee, S, Frandsen, K.E.H, Singh, R.K, Bjerrum, M.J, Lo Leggio, L.
Deposit date:2021-09-28
Release date:2022-03-16
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.06 Å)
Cite:Protonation State of an Important Histidine from High Resolution Structures of Lytic Polysaccharide Monooxygenases.
Biomolecules, 12, 2022
3V9I
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BU of 3v9i by Molmil
Crystal structure of human 1-pyrroline-5-carboxylate dehydrogenase mutant S352L
Descriptor: Delta-1-pyrroline-5-carboxylate dehydrogenase, mitochondrial
Authors:Tanner, J.J, Singh, R.K.
Deposit date:2011-12-27
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:The Three-Dimensional Structural Basis of Type II Hyperprolinemia.
J.Mol.Biol., 420, 2012
3V9H
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BU of 3v9h by Molmil
Crystal structure of human 1-pyrroline-5-carboxylate dehydrogenase mutant S352A
Descriptor: Delta-1-pyrroline-5-carboxylate dehydrogenase, mitochondrial, SULFATE ION
Authors:Tanner, J.J, Singh, R.K.
Deposit date:2011-12-27
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:The Three-Dimensional Structural Basis of Type II Hyperprolinemia.
J.Mol.Biol., 420, 2012
5W46
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BU of 5w46 by Molmil
Structure of S65D Phosphomimetic Ubiquitin Refined at 1.2 Angstroms Resolution
Descriptor: MAGNESIUM ION, Polyubiquitin-B
Authors:Kazansky, Y, Singh, R.K, Fushman, D.
Deposit date:2017-06-09
Release date:2017-07-05
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.18 Å)
Cite:Impact of different ionization states of phosphorylated Serine-65 on ubiquitin structure and interactions.
Sci Rep, 8, 2018
4K57
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BU of 4k57 by Molmil
Structure of Thermus thermophilus 1-pyrroline-5-carboxylate dehydrogenase R100A mutant
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, Delta-1-pyrroline-5-carboxylate dehydrogenase
Authors:Luo, M.L, Singh, R.K, Tanner, J.J.
Deposit date:2013-04-13
Release date:2013-06-19
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.537 Å)
Cite:Structural determinants of oligomerization of delta (1)-pyrroline-5-carboxylate dehydrogenase: identification of a hexamerization hot spot.
J.Mol.Biol., 425, 2013
6ZGQ
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BU of 6zgq by Molmil
AceL NrdHF class 3 split intein GSH linked splice inactive variant - C124A, N146A
Descriptor: AceL NrdHF-1-1 Intein, IODIDE ION
Authors:Hoffmann, S, Mootz, H.D, Kuemmel, D, Singh, R.
Deposit date:2020-06-19
Release date:2020-09-16
Last modified:2021-01-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Biochemical and Structural Characterization of an Unusual and Naturally Split Class 3 Intein.
Chembiochem, 22, 2021
6HLU
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BU of 6hlu by Molmil
Crystal structure of the LRR-Roc-COR domain of the Chlorobium tepidum Roco protein
Descriptor: Rab family protein
Authors:Deyaert, E, Versees, W, Singh, R.
Deposit date:2018-09-11
Release date:2018-12-26
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (3.29 Å)
Cite:Structure and nucleotide-induced conformational dynamics of theChlorobium tepidumRoco protein.
Biochem. J., 476, 2019
7B22
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BU of 7b22 by Molmil
Vibrio cholerae ParD2 Antitoxin
Descriptor: Antitoxin ParD
Authors:Garcia-Rodriguez, G, Loris, R.
Deposit date:2020-11-25
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (3.08 Å)
Cite:Entropic pressure controls the oligomerization of the Vibrio cholerae ParD2 antitoxin.
Acta Crystallogr D Struct Biol, 77, 2021

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