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MolNFT v1 · #160607 · protein

KAPOSI'S sarcoma-associated herpesvirus (kshv), C1 penton vertex register, catc-absent structure

6PPD · Small capsomere-interacting protein: “KAPOSI'S sarcoma-associated herpesvirus (kshv), C1 penton vertex register, catc-absent structure”. Electron microscopy, 20 pockets (best druggability 0.88). MolNFT v1 #160607 on GenesisL1: 3D…

PDB
6PPD
Type
protein
Length
8,728 residues
Chains
16
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Small capsomere-interacting protein; Major capsid protein; Triplex capsid protein 1…
UniProt
Q76RF4, D0UZN7, Q76RF6, C7E5A9
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 12 distinct chains · 31% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
0, 2, 3, 1Small capsomere-interacting proteinprotein7853% helix, 0% strandQ76RF4
WMajor capsid proteinprotein135432% helix, 17% strandD0UZN7
SMajor capsid proteinprotein128130% helix, 17% strandD0UZN7
TMajor capsid proteinprotein136033% helix, 16% strandD0UZN7
4Major capsid proteinprotein122232% helix, 14% strandD0UZN7
ASmall capsomere-interacting proteinprotein4468% helix, 0% strandQ76RF4
5Triplex capsid protein 1protein31423% helix, 28% strandQ76RF6
6, cTriplex capsid protein 2protein29430% helix, 21% strandC7E5A9
7Triplex capsid protein 2protein29129% helix, 18% strandC7E5A9
bTriplex capsid protein 1protein32120% helix, 28% strandQ76RF6
dTriplex capsid protein 2protein30036% helix, 22% strandC7E5A9
XMajor capsid proteinprotein134132% helix, 18% strandD0UZN7

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111050.880.89142empty
25870.880.9390empty
39940.880.89126empty
411550.870.89128empty
510150.860.88107empty

Interfaces

41 interfaces between chains.

  • W–X · 6564 Ų buried · 52 hydrogen bonds · protein-protein
  • S–T · 6486 Ų buried · 56 hydrogen bonds · protein-protein
  • 6–7 · 3509 Ų buried · 14 hydrogen bonds · protein-protein
  • c–d · 3481 Ų buried · 16 hydrogen bonds · protein-protein
  • W–T · 2456 Ų buried · 24 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 6PPD · Kaposi's sarcoma-associated herpesvirus (KSHV), C1 penton vertex register, CATC-absent… · the same entry in another collection · chain 0 against 0, TM-score 1.00

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