UniProt P03176
Thymidine kinase (P03176)
Thymidine kinase (UniProt P03176), EC 2.7.1.21: 64 experimental structures on GenesisL1, 20 ligands bound, 157 pockets. Binding sites, pockets, druggability and 3D structures in GL1X.
- UniProt
- P03176
- Protein
- Thymidine kinase
- EC
- 2.7.1.21
- Experimental structures
- 64
- Predicted models
- 0
- Ligands
- 20
- Pockets
- 157 · 19 records with a druggable one
Structures
64 records of P03176 in the MolNFT archive: 64 experimental, 0 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1E2H | The nucleoside binding site of Herpes simplex type 1 thymidine kinase analyzed by X-ray… | x-ray diffraction | A, B | SO4 | 9 (best 0.79) |
| 1E2H | The nucleoside binding site of herpes simplex type 1 thymidine kinase analyzed by X-ray… | x-ray diffraction | A, B | — | — |
| 1E2I | The nucleoside binding site of Herpes simplex type 1 thymidine kinase analyzed by X-ray… | x-ray diffraction | A, B | SO4, APS, ARP | 10 (best 0.79) |
| 1E2I | The nucleoside binding site of herpes simplex type 1 thymidine kinase analyzed by X-ray… | x-ray diffraction | A, B | — | — |
| 1E2J | The nucleoside binding site of Herpes simplex type 1 thymidine kinase analyzed by X-ray… | x-ray diffraction | A, B | SO4, THM | 9 (best 0.81) |
| 1E2J | The nucleoside binding site of herpes simplex type 1 thymidine kinase analyzed by X-ray… | x-ray diffraction | A, B | — | — |
| 1E2K | Kinetics and crystal structure of the wild-type and the engineered Y101F mutant of Herpes simplex… | x-ray diffraction | A, B | SO4, TMC | 8 (best 0.79) |
| 1E2K | Kinetics and crystal structure of the wild-type and the engineered Y101F mutant of herpes simplex… | x-ray diffraction | A, B | — | — |
| 1E2L | Kinetics and crystal structure of the wild-type and the engineered Y101F mutant of Herpes simplex… | x-ray diffraction | A, B | SO4, TMC | 9 (best 0.80) |
| 1E2L | Kinetics and crystal structure of the wild-type and the engineered Y101F mutant of herpes simplex… | x-ray diffraction | A, B | — | — |
| 1E2M | HPT + HMTT | x-ray diffraction | A, B | SO4, HPT | 9 (best 0.78) |
| 1E2M | HPT + HMTT | x-ray diffraction | A, B | — | — |
| 1E2N | HPT + HMTT | x-ray diffraction | A, B | SO4, RCA | 9 (best 0.82) |
| 1E2N | HPT + HMTT | x-ray diffraction | A, B | — | — |
| 1E2P | Thymidine kinase, DHBT | x-ray diffraction | A, B | SO4, CCV | 9 (best 0.78) |
| 1E2P | Thymidine kinase, dhbt | x-ray diffraction | A, B | — | — |
| 1KI2 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with ganciclovir | x-ray diffraction | A, B | SO4, GA2 | 10 (best 0.80) |
| 1KI2 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with ganciclovir | x-ray diffraction | A, B | — | — |
| 1KI3 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with penciclovir | x-ray diffraction | A, B | SO4, PE2 | 9 (best 0.80) |
| 1KI3 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with penciclovir | x-ray diffraction | A, B | — | — |
| 1KI4 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with… | x-ray diffraction | A, B | SO4, BTD | 7 (best 0.79) |
| 1KI4 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with… | x-ray diffraction | A, B | — | — |
| 1KI6 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with a… | x-ray diffraction | A, B | SO4, AHU | 8 (best 0.79) |
| 1KI6 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with a… | x-ray diffraction | A, B | — | — |
| 1KI7 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with… | x-ray diffraction | A, B | SO4, ID2 | 9 (best 0.78) |
| 1KI7 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with… | x-ray diffraction | A, B | — | — |
| 1KI8 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with… | x-ray diffraction | A, B | SO4, BVD | 7 (best 0.78) |
| 1KI8 | Crystal structure of thymidine kinase from herpes simplex virus type I complexed with… | x-ray diffraction | A, B | — | — |
| 1OF1 | Kinetics and crystal structure of the herpes simplex virus type 1 thymidine kinase interacting with… | x-ray diffraction | A, B | SCT, SO4 | 9 (best 0.78) |
| 1OF1 | Kinetics and crystal structure of the herpes simplex virus type 1 thymidine kinase interacting with… | x-ray diffraction | A, B | — | — |
| 1P7C | Crystal Structure of HSV1-TK complexed with TP5A | x-ray diffraction | A, B | T5A, SO4, THM | 7 (best 0.76) |
| 1P7C | Crystal structure of HSV1-tk complexed with TP5A | x-ray diffraction | A, B | — | — |
| 1QHI | Herpes simplex virus type-I thymidine kinase complexed with a novel non-substrate inhibitor… | x-ray diffraction | A, B | SO4, BPG | 9 (best 0.81) |
| 1QHI | Herpes simplex virus type-I thymidine kinase complexed with a novel non-substrate inhibitor… | x-ray diffraction | A, B | — | — |
| 1VTK | Thymidine kinase from herpes simplex virus type 1 in complex with ADP and… | x-ray diffraction | A | ADP, TMP | 3 (best 0.73) |
| 1VTK | Thymidine kinase from herpes simplex virus type 1 in complex with ADP and… | x-ray diffraction | A | — | — |
| 2KI5 | Herpes simplex type-1 thymidine kinase in complex with the drug aciclovir at 1.9A resolution | x-ray diffraction | A, B | SO4, AC2 | 7 (best 0.80) |
| 2KI5 | Herpes simplex type-1 thymidine kinase in complex with the drug aciclovir at 1.9A resolution | x-ray diffraction | A, B | — | — |
| 2VTK | Thymidine kinase from herpes simplex virus type 1 in complex with ADP and deoxythymidine | x-ray diffraction | A | — | — |
| 2VTK | Thymidine kinase from herpes simplex virus type 1 in complex with ADP and deoxythymidine | x-ray diffraction | A | — | — |
| 3F0T | Crystal structure of thymidine kinase from Herpes simplex virus type 1 in complex with N-methyl-DHBT | x-ray diffraction | A, B | — | — |
| 3F0T | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with N-methyl-dhbt | x-ray diffraction | A, B | — | — |
| 3RDP | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with N-METHYL-FHBT | x-ray diffraction | A, B | — | — |
| 3RDP | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with N-methyl-fhbt | x-ray diffraction | A, B | — | — |
| 3VTK | Thymidine kinase from herpes simplex virus type 1 in complex with ADP and… | x-ray diffraction | A | — | — |
| 3VTK | Thymidine kinase from herpes simplex virus type 1 in complex with ADP and… | x-ray diffraction | A | — | — |
| 4IVP | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with IN51/20 | x-ray diffraction | A, B | — | — |
| 4IVP | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with IN51/20 | x-ray diffraction | A, B | — | — |
| 4IVQ | Crystal structure of thymidine kinase from Herpes simplex virus type 1 in complex with IN43/5 | x-ray diffraction | A, B | — | — |
| 4IVQ | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with IN43/5 | x-ray diffraction | A, B | — | — |
| 4IVR | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with IN52/10 | x-ray diffraction | A, B | — | — |
| 4IVR | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with IN52/10 | x-ray diffraction | A, B | — | — |
| 4JBX | Crystal structure of thymidine kinase from Herpes simplex virus type 1 in complex with SK-78 | x-ray diffraction | A, B | — | — |
| 4JBX | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with sk-78 | x-ray diffraction | A, B | — | — |
| 4JBY | Crystal structure of thymidine kinase from Herpes simplex virus type 1 in complex with F-SK78 | x-ray diffraction | A, B | — | — |
| 4JBY | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with F-SK78 | x-ray diffraction | A, B | — | — |
| 4OQL | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with dF-EdU | x-ray diffraction | A, B | — | — |
| 4OQL | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with df-edu | x-ray diffraction | A, B | — | — |
| 4OQM | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with F-ARA-EdU | x-ray diffraction | A, B | — | — |
| 4OQM | Crystal structure of thymidine kinase from herpes simplex virus type 1 in complex with F-ara-edu | x-ray diffraction | A, B | — | — |
4 records more on the page itself.
Ligands
- SO4 · Sulfate ion · in 18 records
- THM · Thymidine · in 2 records
- TMC · 1-[4-hydroxy-5-(hydroxymethyl)bicyclo[3.1.0]hex-2-yl]-5-methylpyrimidine-2,4(1H,3H)-dione · in 2 records
- AC2 · 9-hyroxyethoxymethylguanine · in 1 record
- ADP · Adenosine-5'-diphosphate · in 1 record
- AHU · 1',5'-anhydro-2',3'-dideoxy-2'-(5-iodouracil-1-yl)-D-ababino-hexitol · in 1 record
- APS · 9-hydroxypropyladenine, S-isomer · in 1 record
- ARP · 9-hydroxypropyladenine, R-isomer · in 1 record
- BPG · 9-(4-hydroxybutyl)-N2-phenylguanine · in 1 record
- BTD · 5-bromothienyldeoxyuridine · in 1 record
- BVD · 5-bromovinyldeoxyuridine · in 1 record
- CCV · 6-[3-hydroxy-2-(hydroxymethyl)propyl]-5-methyl-2,4(1H,3H)-pyrimidinedione · in 1 record
- GA2 · 9-(1,3-dihydroxy-propoxymethane)guanine · in 1 record
- HPT · 6-hydroxypropylthymine · in 1 record
- ID2 · 5-iododeoxyuridine · in 1 record
- PE2 · 9-(4-hydroxy-3-(hydroxymethyl)but-1-yl)guanine · in 1 record
- RCA · 6-{[4-(hydroxymethyl)-5-methyl-2,6-dioxohexahydropyrimidin-5-yl]methyl}-5-methylpyrimidine-2,4(1H,3H)-dione · in 1 record
- SCT · (south)-methanocarba-thymidine · in 1 record
- T5A · P1-(5'-adenosyl)p5-(5'-thymidyl)pentaphosphate · in 1 record
- TMP · Thymidine-5'-phosphate · in 1 record
Elsewhere
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