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MolNFT v1 · #160605 · protein

KAPOSI'S sarcoma-associated herpesvirus (kshv), C5 portal vertex structure

6PPB · Capsid vertex component 1: “KAPOSI'S sarcoma-associated herpesvirus (kshv), C5 portal vertex structure”. Electron microscopy, 20 pockets (best druggability 0.89). MolNFT v1 #160605 on GenesisL1: 3D structure, binding sites and…

PDB
6PPB
Type
protein
Length
7,953 residues
Chains
19
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid vertex component 1; Capsid vertex component 2; Large tegument protein deneddylase…
EC
3.4.19.12, 3.4.22.-
UniProt
Q76RH8, Q76RI7, Q2HR64, Q2HRA7, Q76RF6, Q98832, Q76RF4
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 14 distinct chains · 32% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
kCapsid vertex component 1protein34430% helix, 23% strandQ76RH8
lCapsid vertex component 2protein8377% helix, 1% strandQ76RI7
mCapsid vertex component 2protein8071% helix, 1% strandQ76RI7
n, oLarge tegument protein deneddylase (EC 3.4.19.12, 3.4.22.-)protein4088% helix, 0% strandQ2HR64
SMajor capsid proteinprotein128128% helix, 16% strandQ2HRA7
TMajor capsid proteinprotein136033% helix, 16% strandQ2HRA7
WMajor capsid proteinprotein135433% helix, 15% strandQ2HRA7
XMajor capsid proteinprotein128831% helix, 17% strandQ2HRA7
bTriplex capsid protein 1protein32123% helix, 27% strandQ76RF6
c, 6Triplex capsid protein 2protein29432% helix, 19% strandQ98832
dTriplex capsid protein 2protein30037% helix, 22% strandQ98832
5Triplex capsid protein 1protein26821% helix, 26% strandQ76RF6
7Triplex capsid protein 2protein29434% helix, 18% strandQ98832
0, 1, 2, 3Small capsomere-interacting proteinprotein7858% helix, 0% strandQ76RF4

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18750.890.92125empty
211150.890.90145empty
38260.880.91111empty
411530.880.89155empty
510520.870.88118empty

Interfaces

47 interfaces between chains.

  • S–T · 6491 Ų buried · 53 hydrogen bonds · protein-protein
  • W–X · 6446 Ų buried · 41 hydrogen bonds · protein-protein
  • S–X · 5200 Ų buried · 50 hydrogen bonds · protein-protein
  • 6–7 · 3598 Ų buried · 18 hydrogen bonds · protein-protein
  • c–d · 3583 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 7 disulfide (disulfide).

Compared structures

  • 6PPB · Kaposi's sarcoma-associated herpesvirus (KSHV), C5 portal vertex structure · the same entry in another collection · chain k against k, TM-score 1.00

Analyse

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