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MolNFT v1 · #91551 · protein + DNA

Crystal structure of the SV40 large T-antigen origin bining domain bound to site I DNA

4FGN · Large T antigen: “Crystal structure of the SV40 large T-antigen origin bining domain bound to site I DNA”. X-ray diffraction, 5 pockets (best druggability 0.45). MolNFT v1 #91551 on GenesisL1: 3D structure, binding sites and pockets…

PDB
4FGN
Type
protein + DNA
Length
296 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Large T antigen; Site I DNA
EC
3.6.4.-
UniProt
P03070
Pockets
5 · best druggability 0.45

Structure

x-ray diffraction · 4 distinct chains · 30% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALarge T antigen (EC 3.6.4.-)protein12631% helix, 29% strandP03070
BLarge T antigen (EC 3.6.4.-)protein12430% helix, 27% strandP03070
ZSite I DNAdna23——
YSite I DNAdna23——

Pockets

5 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11710.450.7525empty
2600.400.8016empty
3840.310.7414empty
4630.280.7413empty
5570.260.7311empty

Interfaces

6 interfaces between chains.

  • Z–Y · 981 Ų buried · 77 hydrogen bonds · nucleic-nucleic
  • A–Y · 416 Ų buried · 12 hydrogen bonds · protein-nucleic
  • B–Y · 384 Ų buried · 18 hydrogen bonds · protein-nucleic
  • A–Z · 351 Ų buried · 9 hydrogen bonds · protein-nucleic
  • B–Z · 314 Ų buried · 7 hydrogen bonds · protein-nucleic

Compared structures

  • 4FGN · Crystal structure of the SV40 large T-antigen origin bining domain bound to Site I DNA · the same entry in another collection · chain A against A, TM-score 1.00

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