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MolNFT v1 · #160611 · protein

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

6PPH · Capsid vertex component 1: “KAPOSI'S sarcoma-associated herpesvirus (kshv), C1 penton vertex register, catc-binding structure”. Electron microscopy, 20 pockets (best druggability 0.89). MolNFT v1 #160611 on GenesisL1: 3D structure…

PDB
6PPH
Type
protein
Length
9,326 residues
Chains
21
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, Q76RF6, C7E5A9, D0UZN7, Q76RF4
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 17 distinct chains · 32% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
kCapsid vertex component 1protein34430% helix, 24% strandQ76RH8
lCapsid vertex component 2protein8377% helix, 2% strandQ76RI7
mCapsid vertex component 2protein8070% helix, 1% strandQ76RI7
n, oLarge tegument protein deneddylase (EC 3.4.19.12, 3.4.22.-)protein4090% helix, 0% strandQ2HR64
5Triplex capsid protein 1protein31423% helix, 27% strandQ76RF6
6Triplex capsid protein 2protein30234% helix, 21% strandC7E5A9
7Triplex capsid protein 2protein29433% helix, 23% strandC7E5A9
bTriplex capsid protein 1protein32123% helix, 27% strandQ76RF6
cTriplex capsid protein 2protein29429% helix, 20% strandC7E5A9
dTriplex capsid protein 2protein30035% helix, 22% strandC7E5A9
4Major capsid proteinprotein122231% helix, 14% strandD0UZN7
ASmall capsomere-interacting proteinprotein4466% helix, 0% strandQ76RF4
2, 3, 1, 0Small capsomere-interacting proteinprotein7859% helix, 0% strandQ76RF4
SMajor capsid proteinprotein128128% helix, 18% strandD0UZN7
TMajor capsid proteinprotein136031% helix, 16% strandD0UZN7
XMajor capsid proteinprotein134131% helix, 18% strandD0UZN7
WMajor capsid proteinprotein135431% helix, 16% strandD0UZN7

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111300.890.91144empty
27190.870.91104empty
39400.870.89109empty
411090.870.88128empty
55320.870.9388empty

Interfaces

60 interfaces between chains.

  • X–W · 6480 Ų buried · 54 hydrogen bonds · protein-protein
  • S–T · 6446 Ų buried · 58 hydrogen bonds · protein-protein
  • 6–7 · 3628 Ų buried · 17 hydrogen bonds · protein-protein
  • c–d · 3477 Ų buried · 17 hydrogen bonds · protein-protein
  • T–W · 2505 Ų buried · 26 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

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

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