Compound three letter code : MTX
 
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REL
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X-ray diffraction
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Authors  (349)
Anderson KS
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Czyzyk DJ
(14)
Kraut J
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Valhondo M
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Deiana L
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Tirado-Rives J
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Sawaya MR
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Benkovic SJ
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Brown KA
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Chen C-J
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Cody V
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Howell EE
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Luft JR
(4)
Pangborn W
(4)
Bennett BC
(3)
Center for Structural Genomics of Infectious Diseases (CSGID)
(3)
Dealwis CG
(3)
French JB
(3)
Hammes-Schiffer S
(3)
Hanoian P
(3)
Joachimiak A
(3)
Kim Y
(3)
Kumar VP
(3)
Liu CT
(3)
Makowska-Grzyska M
(3)
Maltseva N
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Oatley SJ
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Ahmad MF
(2)
Alexandrov K
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Anderson WF
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Angelaccio S
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Asbury JB
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Banerjee S
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Bolin JT
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Bystroff C
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Canyuk B
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Chattopadhyay D
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Chen CJ
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Chuankhayan P
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Contestabile R
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Davis JH
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Dunbar J
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Fanning SW
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Farber GK
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Filman DJ
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Lin C-C
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Martucci WE
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Ungerer JPJ
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Vargo MA
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Walden P
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Wan Q
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Wang Y
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Homo / hetero assembly  (2)
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Assembly polymer count  (5)
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tetramer
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heptamer
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Resolution distribution
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(2)
1.5 - 2
(29)
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(24)
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(18)
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(9)
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To be published
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Macromolecules
Organism superkingdom  (3)
Eukaryota
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Representative Structures
Representative Structures
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Entries 1 to 10 of 85
Entries 1 to 10 of 85
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Crystal structure of White Spot Syndrome Virus Thymidylate Synthase - ternary complex with Methotrexate and dUMP
Panchal NV, Kumar S, Shaikh N, Vasudevan D
Int J Biol Macromol (2021) [PMID: 33197475  ]
Assembly composition: protein only structure
Bound ligands: MTX    UMP    UMP    MTX   
Assembly name: thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-181211 (Preferred)   search this ID
PDBe-KB: Q77J90   
X-ray diffraction
2.75Å resolution
Released: 25 Nov 2020
Model geometry
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7cca
7cca
7cca
Crystal structure of mutant V45A Brugia malayi thymidylate synthase complexed with 2'-deoxyuridine monophosphate and methotrexate
Keyunratsami K, Nualnoi T, Wongkamchai S, Songsiriritthigul C, Chen C-J, Canyuk B
To be published
Source organism: Brugia malayi  
Assembly composition: protein only structure
Bound ligands: GOL    BME    MTX    UMP    UMP    MTX   
Assembly name: Thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-105142 (Preferred)   search this ID
PDBe-KB: A0A1P6CBU1   
X-ray diffraction
1.6Å resolution
Released: 22 Dec 2021
Model geometry
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7dp5
7dp5
7dp5
Crystal structure of wild type Brugia malayi thymidylate synthase complexed with 2'-deoxyuridine monophosphate and methotrexate
Keyunratsami K, Nualnoi T, Wongkamchai S, Songsiriritthigul C, Chen C-J, Canyuk B
To be published
Source organism: Brugia malayi  
Assembly composition: protein only structure
Bound ligands: BME    MTX    UMP    UMP    MTX   
Assembly name: Thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-105142 (Preferred)   search this ID
PDBe-KB: A0A1P6CBU1   
X-ray diffraction
1.5Å resolution
Released: 22 Dec 2021
Model geometry
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7dp4
7dp4
7dp4
Enterococcus faecalis thymidylate synthase complex with methotrexate
Mangani S, Pozzi C
Eur J Med Chem (2016) [PMID: 27517810  ]
Source organism: Enterococcus faecalis  
Assembly composition: protein only structure
Bound ligands: MTX    SO4    MTX   
Assembly name: Thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-182802 (Preferred)   search this ID
PDBe-KB: Q834R3   
X-ray diffraction
2.5Å resolution
Released: 28 Sep 2016
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5j7w
5j7w
5j7w
Crystal Structure of Bifunctional Enzyme FolD-Methylenetetrahydrofolate Dehydrogenase/Cyclohydrolase in the Complex with Methotrexate from Campylobacter jejuni
Kim Y, Makowska-Grzyska M, Maltseva N, Grimshaw S, Joachimiak A, Center for Structural Genomics of Infectious Diseases (CSGID)
To be published
Assembly composition: protein only structure
Bound ligands: K    GUN    K    GOL    DTT    GUN    MTX    TRS    CL    TRS    DTT    MTX   
Assembly name: Bifunctional protein FolD (Preferred)   search this complex
PDBe complex ID: PDB-CPX-171038 (Preferred)   search this ID
PDBe-KB: Q0PA35   
X-ray diffraction
1.7Å resolution
Released: 23 May 2018
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6deb
6deb
6deb
Human thymidylate synthase in complex with dUMP and methotrexate
Chen D, Jansson A, Larsson A, Nordlund P
J Biol Chem (2017) [PMID: 28634233  ]
Source organism: Homo sapiens  
Assembly composition: protein only structure
Bound ligands: MTX    UMP    UMP    MTX   
Assembly name: Thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-138196 (Preferred)   search this ID
PDBe-KB: P04818   
X-ray diffraction
1.99Å resolution
Released: 28 Jun 2017
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5x66
5x66
5x66
Crystal structure of TS-DHFR from Cryptosporidium hominis in complex with NADPH, FdUMP and 2-(2-(4-((2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl)benzamido)phenyl)acetic acid.
Czyzyk DJ, Valhondo M, Jorgensen WL, Anderson KS
Eur J Med Chem (2019) [PMID: 31536894  ]
Assembly composition: protein only structure
Bound ligands: NDP    OF7    UFP    MTX    UFP    OF7    SO4    MTX   
Assembly name: Bifunctional dihydrofolate reductase-thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-102697 (Preferred)   search this ID
PDBe-KB: A0A0S4TER9   
X-ray diffraction
2.89Å resolution
Released: 2 Oct 2019
Model geometry
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6pf9
6pf9
6pf9
Crystal structure of TS-DHFR from Cryptosporidium hominis in complex with NADPH, FdUMP and 2-(4-((2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl)benzamido)benzoic acid
Czyzyk DJ, Valhondo M, Jorgensen WL, Anderson KS
Eur J Med Chem (2019) [PMID: 31536894  ]
Assembly composition: protein only structure
Bound ligands: NDP    UFP    MTX    UFP    SO4    OG7    MTX    OG7   
Assembly name: Bifunctional dihydrofolate reductase-thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-102697 (Preferred)   search this ID
PDBe-KB: A0A0S4TER9   
X-ray diffraction
2.795Å resolution
Released: 2 Oct 2019
Model geometry
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Data not analysed
6pf7
6pf7
6pf7
Crystal structure of TS-DHFR from Cryptosporidium hominis in complex with NADPH, FdUMP and 2-(4-((2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl)benzamido)-4-carbamoylbenzoic acid.
Czyzyk DJ, Valhondo M, Jorgensen WL, Anderson KS
Eur J Med Chem (2019) [PMID: 31536894  ]
Assembly composition: protein only structure
Bound ligands: NDP    OFJ    UFP    MTX    UFP    SO4    OFJ    MTX   
Assembly name: Bifunctional dihydrofolate reductase-thymidylate synthase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-102697 (Preferred)   search this ID
PDBe-KB: A0A0S4TER9   
X-ray diffraction
2.706Å resolution
Released: 2 Oct 2019
Model geometry
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6pfg
6pfg
6pfg
The high resolution structure of dihydrofolate reductase from Yersinia pestis complex with methotrexate as closed form
Chang C, Maltseva N, Kim Y, Makowska-Grzyska M, Mulligan R, Papazisi L, Anderson WF, Joachimiak A, Center for Structural Genomics of Infectious Diseases (CSGID)
To be published
Source organism: Yersinia pestis CO92  
Assembly composition: protein only structure
Bound ligands: K    CA    K    CA    MTX    CL    MTX   
Modified residues: MSE    MSE   
Assembly name: Dihydrofolate reductase (Preferred)   search this complex
PDBe complex ID: PDB-CPX-104916 (Preferred)   search this ID
PDBe-KB: A0A3N4BLI0   
X-ray diffraction
2.051Å resolution
Released: 3 Feb 2016
Model geometry
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5hi6
5hi6
5hi6
...
Entries 1 to 10 of 85
Entries 1 to 10 of 85