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The atomic structure of hadv-F41 at pH 7.4

Analyse The atomic structure of hadv-F41 at pH 7.4 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6Z7N
Type
protein
Length
11,892 residues
Chains
36
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pre-protein VI; Hexon protein; Penton protein; Core-capsid bridging protein…
UniProt
P16139, P11820, Q9QAH8, B5SNS2, Q67716, B5SNR3, P11822
Pockets
20 · best druggability 0.90

Structure

electron microscopy · 32 distinct chains · 11% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
0Pre-protein VIprotein120% helix, 0% strandP16139
1Pre-protein VIprotein160% helix, 13% strandP16139
2Pre-protein VIprotein60% helix, 0% strandP16139
3Pre-protein VIprotein120% helix, 0% strandP16139
4Pre-protein VIprotein190% helix, 11% strandP16139
5Pre-protein VIprotein160% helix, 6% strandP16139
6, 7, 9Pre-protein VIprotein30% helix, 0% strandP16139
8Pre-protein VIprotein260% helix, 0% strandP16139
AHexon proteinprotein78811% helix, 15% strandP11820
BHexon proteinprotein84711% helix, 12% strandP11820
CHexon proteinprotein8608% helix, 14% strandP11820
DHexon proteinprotein8879% helix, 12% strandP11820
EHexon proteinprotein8789% helix, 12% strandP11820
FHexon proteinprotein88912% helix, 15% strandP11820
GHexon proteinprotein88012% helix, 16% strandP11820
HHexon proteinprotein89412% helix, 19% strandP11820
IHexon proteinprotein90814% helix, 20% strandP11820
JHexon proteinprotein90710% helix, 14% strandP11820
KHexon proteinprotein84014% helix, 22% strandP11820
LHexon proteinprotein85511% helix, 22% strandP11820
MPenton proteinprotein4586% helix, 28% strandQ9QAH8
NCore-capsid bridging proteinprotein240% helix, 8% strandB5SNS2
OPre-hexon-linking protein iiiaprotein26743% helix, 1% strandQ67716
P, SHexon-interlacing proteinprotein580% helix, 5% strandB5SNR3
QHexon-interlacing proteinprotein500% helix, 6% strandB5SNR3
RHexon-interlacing proteinprotein300% helix, 3% strandB5SNR3
TPre-hexon-linking protein VIIIprotein17820% helix, 11% strandP11822
UPre-hexon-linking protein VIIIprotein17922% helix, 12% strandP11822
XFiber proteinprotein70% helix, 0% strand—
W, ZUnknownprotein90% helix, 0% strand—
VUnknownprotein100% helix, 10% strand—
YUnknownprotein60% helix, 0% strand—

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16030.900.96137empty
211740.860.87129empty
35030.860.9288empty
410470.840.85122empty
52430.820.9434empty

Interfaces

110 interfaces between chains.

  • G–I · 8767 Ų buried · 121 hydrogen bonds · protein-protein
  • D–E · 8597 Ų buried · 132 hydrogen bonds · protein-protein
  • D–F · 8479 Ų buried · 126 hydrogen bonds · protein-protein
  • J–K · 8460 Ų buried · 111 hydrogen bonds · protein-protein
  • H–I · 8436 Ų buried · 121 hydrogen bonds · protein-protein

Compared structures

  • 6Z7N · The atomic structure of HAdV-F41 at pH 7.4 · the same entry in another collection · chain 5 against 5, TM-score 1.00

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