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4FM5
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BU of 4fm5 by Molmil
X-ray structure of des-methylflurbiprofen bound to murine COX-2
分子名称: (2-fluorobiphenyl-4-yl)acetic acid, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Xu, S, Banerjee, S, Windsor, M.A, Marnett, L.J.
登録日2012-06-15
公開日2012-08-29
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.81 Å)
主引用文献Substrate-Selective Inhibition of Cyclooxygenase-2: Development and Evaluation of Achiral Profen Probes.
ACS Med Chem Lett, 3, 2012
6WQX
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BU of 6wqx by Molmil
Human PRPK-TPRKB complex
分子名称: EKC/KEOPS complex subunit TP53RK, EKC/KEOPS complex subunit TPRKB, MAGNESIUM ION, ...
著者Li, J, Ma, X.L, Banerjee, S, Dong, Z.G.
登録日2020-04-29
公開日2021-02-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.53 Å)
主引用文献Crystal structure of the human PRPK-TPRKB complex.
Commun Biol, 4, 2021
5EKE
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BU of 5eke by Molmil
Structure of the polyisoprenyl-phosphate glycosyltransferase GtrB (F215A mutant)
分子名称: MAGNESIUM ION, URIDINE-5'-DIPHOSPHATE, Uncharacterized glycosyltransferase sll0501
著者Ardiccioni, C, Clarke, O.B, Tomasek, D, Banerjee, S, Rajashankar, K.R, Liu, Q, Shapiro, L, Mancia, F, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2015-11-03
公開日2016-01-06
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (3.001 Å)
主引用文献Structure of the polyisoprenyl-phosphate glycosyltransferase GtrB and insights into the mechanism of catalysis.
Nat Commun, 7, 2016
5F15
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BU of 5f15 by Molmil
Crystal Structure of ArnT from Cupriavidus metallidurans bound to Undecaprenyl phosphate
分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 4-amino-4-deoxy-L-arabinose (L-Ara4N) transferase, CHLORIDE ION, ...
著者Petrou, V.I, Clarke, O.B, Tomasek, D, Banerjee, S, Rajashankar, K.R, Mancia, F, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2015-11-30
公開日2016-02-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Structures of aminoarabinose transferase ArnT suggest a molecular basis for lipid A glycosylation.
Science, 351, 2016
6X6O
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BU of 6x6o by Molmil
Crystal structure of T4 protein Spackle as determined by native SAD phasing
分子名称: CHLORIDE ION, Protein spackle
著者Shi, K, Kurniawan, F, Banerjee, S, Moeller, N.H, Aihara, H.
登録日2020-05-28
公開日2020-09-16
実験手法X-RAY DIFFRACTION (1.52 Å)
主引用文献Crystal structure of bacteriophage T4 Spackle as determined by native SAD phasing.
Acta Crystallogr D Struct Biol, 76, 2020
5EZM
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BU of 5ezm by Molmil
Crystal Structure of ArnT from Cupriavidus metallidurans in the apo state
分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 4-amino-4-deoxy-L-arabinose transferase or related glycosyltransferases of PMT family, CHLORIDE ION, ...
著者Petrou, V.I, Clarke, O.B, Tomasek, D, Banerjee, S, Rajashankar, K.R, Mancia, F, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2015-11-26
公開日2016-02-17
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Structures of aminoarabinose transferase ArnT suggest a molecular basis for lipid A glycosylation.
Science, 351, 2016
6WM5
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BU of 6wm5 by Molmil
Structure of a phosphatidylinositol-phosphate synthase (PIPS) from Mycobacterium kansasii
分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHATE, 3,3',3''-phosphanetriyltripropanoic acid, ...
著者Belcher Dufrisne, M, Jorge, C.D, Timoteo, C.G, Petrou, V.I, Ashraf, K.U, Banerjee, S, Clarke, O.B, Santos, H, Mancia, F, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2020-04-20
公開日2020-05-27
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.961 Å)
主引用文献Structural and Functional Characterization of Phosphatidylinositol-Phosphate Biosynthesis in Mycobacteria.
J.Mol.Biol., 432, 2020
5EKP
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BU of 5ekp by Molmil
Structure of the polyisoprenyl-phosphate glycosyltransferase GtrB (WT)
分子名称: MAGNESIUM ION, URIDINE-5'-DIPHOSPHATE, Uncharacterized glycosyltransferase sll0501
著者Ardiccioni, C, Clarke, O.B, Tomasek, D, Banerjee, S, Rajashankar, K.R, Liu, Q, Shapiro, L, Mancia, F, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2015-11-03
公開日2016-01-06
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (3.194 Å)
主引用文献Structure of the polyisoprenyl-phosphate glycosyltransferase GtrB and insights into the mechanism of catalysis.
Nat Commun, 7, 2016
4GC7
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BU of 4gc7 by Molmil
Crystal structure of Dpo4 in complex with S-MC-dADP opposite dT
分子名称: CALCIUM ION, DNA (5'-D(*G*GP*GP*GP*GP*AP*AP*GP*GP*AP*TP*TP*CP*C)-3'), DNA (5'-D(*TP*CP*AP*TP*GP*GP*AP*AP*TP*CP*CP*TP*TP*CP*CP*CP*CP*C)-3'), ...
著者Eoff, R.L, Ketkar, A, Banerjee, S, Zafar, M.K.
登録日2012-07-29
公開日2012-10-24
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.89 Å)
主引用文献Differential furanose selection in the active sites of archaeal DNA polymerases probed by fixed-conformation nucleotide analogues.
Biochemistry, 51, 2012
7K32
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BU of 7k32 by Molmil
Crystal structure of Endonuclease Q complex with 27-mer duplex substrate with an abasic lesion at the active site
分子名称: DNA (27-MER), Endonuclease Q, MAGNESIUM ION, ...
著者Shi, K, Moeller, N.M, Banerjee, S, Yin, L, Orellana, K, Aihara, H.
登録日2020-09-10
公開日2021-03-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.11 Å)
主引用文献Structural basis for recognition of distinct deaminated DNA lesions by endonuclease Q.
Proc.Natl.Acad.Sci.USA, 118, 2021
7K33
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BU of 7k33 by Molmil
Crystal structure of Endonuclease Q complex with 27-mer duplex substrate with an abasic lesion at the active site
分子名称: DNA (27-MER), Endonuclease Q, MAGNESIUM ION, ...
著者Shi, K, Moeller, N.M, Banerjee, S, Yin, L, Orellana, K, Aihara, H.
登録日2020-09-10
公開日2021-03-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.11 Å)
主引用文献Structural basis for recognition of distinct deaminated DNA lesions by endonuclease Q.
Proc.Natl.Acad.Sci.USA, 118, 2021
7K30
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BU of 7k30 by Molmil
Crystal structure of Endonuclease Q complex with 27-mer duplex substrate with dU at the active site
分子名称: 1,2-ETHANEDIOL, DNA (27-MER), Endonuclease Q, ...
著者Shi, K, Moeller, N.M, Banerjee, S, Yin, L, Orellana, K, Aihara, H.
登録日2020-09-10
公開日2021-03-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Structural basis for recognition of distinct deaminated DNA lesions by endonuclease Q.
Proc.Natl.Acad.Sci.USA, 118, 2021
7K31
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BU of 7k31 by Molmil
Crystal structure of Endonuclease Q complex with 27-mer duplex substrate with dI at the active site
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, DNA (27-MER), ...
著者Shi, K, Moeller, N.M, Banerjee, S, Yin, L, Orellana, K, Aihara, H.
登録日2020-09-10
公開日2021-03-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.88 Å)
主引用文献Structural basis for recognition of distinct deaminated DNA lesions by endonuclease Q.
Proc.Natl.Acad.Sci.USA, 118, 2021
4GC6
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BU of 4gc6 by Molmil
Crystal structure of Dpo4 in complex with N-MC-dAMP opposite dT
分子名称: CALCIUM ION, DNA (5'-D(*GP*GP*GP*GP*GP*AP*AP*GP*GP*AP*TP*TP*CP*C)-3'), DNA (5'-D(*TP*CP*AP*TP*GP*GP*AP*AP*TP*CP*CP*TP*TP*CP*CP*CP*CP*C)-3'), ...
著者Eoff, R.L, Ketkar, A, Banerjee, S, Zafar, M.K.
登録日2012-07-29
公開日2012-10-24
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.895 Å)
主引用文献Differential furanose selection in the active sites of archaeal DNA polymerases probed by fixed-conformation nucleotide analogues.
Biochemistry, 51, 2012
4OTJ
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BU of 4otj by Molmil
The complex of murine cyclooxygenase-2 with a conjugate of indomefathin and podophyllotoxin, N-{(succinylpodophyllotoxinyl)but-4-yl}-2-{1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl}acetamide
分子名称: (5S,5aS,8aS,9S)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 4-{[4-({[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl}amino)butyl]amino}-4-oxobutanoate, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Xu, S, Uddin, M.J, Banerjee, S, Marnett, L.J.
登録日2014-02-13
公開日2015-04-08
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Antitumor Activity of Cytotoxic Cyclooxygenase-2 Inhibitors.
Acs Chem.Biol., 11, 2016
6B0B
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BU of 6b0b by Molmil
Crystal structure of human APOBEC3H
分子名称: APOBEC3H, MCherry, RNA (5'-R(*UP*AP*AP*AP*AP*AP*AP*A)-3'), ...
著者Shaban, N.M, Shi, K, Banerjee, S, Harris, R.S, Aihara, H.
登録日2017-09-14
公開日2017-10-25
最終更新日2019-12-04
実験手法X-RAY DIFFRACTION (3.2800622 Å)
主引用文献The Antiviral and Cancer Genomic DNA Deaminase APOBEC3H Is Regulated by an RNA-Mediated Dimerization Mechanism.
Mol. Cell, 69, 2018
5TD5
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BU of 5td5 by Molmil
Crystal Structure of Human APOBEC3B variant complexed with ssDNA
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, DNA (5'-D(P*TP*TP*CP*AP*T)-3'), ...
著者Shi, K, Banerjee, S, Kurahashi, K, Aihara, H.
登録日2016-09-16
公開日2016-12-28
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.718 Å)
主引用文献Structural basis for targeted DNA cytosine deamination and mutagenesis by APOBEC3A and APOBEC3B.
Nat. Struct. Mol. Biol., 24, 2017
6BBO
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BU of 6bbo by Molmil
Crystal structure of human APOBEC3H/RNA complex
分子名称: APOBEC3H, GLYCEROL, MCherry fluorescent protein, ...
著者Shaban, N.M, Shi, K, Banerjee, S, Harris, R.S, Aihara, H.
登録日2017-10-19
公開日2018-01-10
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (3.428 Å)
主引用文献The Antiviral and Cancer Genomic DNA Deaminase APOBEC3H Is Regulated by an RNA-Mediated Dimerization Mechanism.
Mol. Cell, 69, 2018
5U90
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BU of 5u90 by Molmil
Crystal structure of Co-CAO1 in complex with resveratrol
分子名称: COBALT (II) ION, Carotenoid oxygenase 1, DIMETHYL SULFOXIDE, ...
著者Sui, X, Palczewski, k, Banerjee, S, Kiser, P.D.
登録日2016-12-15
公開日2017-05-31
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure and Spectroscopy of Alkene-Cleaving Dioxygenases Containing an Atypically Coordinated Non-Heme Iron Center.
Biochemistry, 56, 2017
5U8X
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BU of 5u8x by Molmil
Crystal structure of Fe-CAO1
分子名称: BENZOIC ACID, CHLORIDE ION, Carotenoid oxygenase 1, ...
著者Sui, X, Palczewski, K, Banerjee, S, Kiser, P.D.
登録日2016-12-15
公開日2017-05-31
最終更新日2024-07-10
実験手法X-RAY DIFFRACTION (2.165 Å)
主引用文献Structure and Spectroscopy of Alkene-Cleaving Dioxygenases Containing an Atypically Coordinated Non-Heme Iron Center.
Biochemistry, 56, 2017
5U97
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BU of 5u97 by Molmil
Crystal structure of Co-CAO1 in complex with piceatannol
分子名称: BENZOIC ACID, COBALT (II) ION, Carotenoid oxygenase 1, ...
著者Sui, X, Palczewski, K, Banerjee, S, Kiser, P.D.
登録日2016-12-15
公開日2017-05-31
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structure and Spectroscopy of Alkene-Cleaving Dioxygenases Containing an Atypically Coordinated Non-Heme Iron Center.
Biochemistry, 56, 2017
4O1Z
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BU of 4o1z by Molmil
Crystal Structure of Ovine Cyclooxygenase-1 Complex with Meloxicam
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 4-hydroxy-2-methyl-N-(5-methyl-1,3-thiazol-2-yl)-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxide, ...
著者Xu, S, Hermanson, D.J, Banerjee, S, Ghebreselasie, K, Clayton, G.M, Garavito, R.M, Marnett, L.J.
登録日2013-12-16
公開日2014-01-22
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Oxicams Bind in a Novel Mode to the Cyclooxygenase Active Site via a Two-water-mediated H-bonding Network.
J.Biol.Chem., 289, 2014
5U8Y
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BU of 5u8y by Molmil
Crystal structure of Co-CAO1
分子名称: COBALT (II) ION, Carotenoid oxygenase 1
著者Sui, X, Palczewski, K, Banerjee, S, Kiser, P.D.
登録日2016-12-15
公開日2017-05-31
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure and Spectroscopy of Alkene-Cleaving Dioxygenases Containing an Atypically Coordinated Non-Heme Iron Center.
Biochemistry, 56, 2017
5SWW
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BU of 5sww by Molmil
Crystal Structure of Human APOBEC3A complexed with ssDNA
分子名称: DNA 15-Mer, DNA dC->dU-editing enzyme APOBEC-3A, GLYCEROL, ...
著者Shi, K, Banerjee, S, Kurahashi, K, Aihara, H.
登録日2016-08-09
公開日2016-12-28
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (3.151 Å)
主引用文献Structural basis for targeted DNA cytosine deamination and mutagenesis by APOBEC3A and APOBEC3B.
Nat. Struct. Mol. Biol., 24, 2017
4OTY
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BU of 4oty by Molmil
Crystal structure of lumiracoxib bound to the apo-mouse-cyclooxygenase-2
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Prostaglandin G/H synthase 2, ...
著者Xu, S, Windsor, M.A, Banerjee, S, Marnett, L.J.
登録日2014-02-14
公開日2014-02-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.354 Å)
主引用文献Exploring the molecular determinants of substrate-selective inhibition of cyclooxygenase-2 by lumiracoxib.
Bioorg.Med.Chem.Lett., 23, 2013

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