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MolNFT v1 · #115777 · protein

Crystal structure of human SART3 hat-C domain-human USP4 dusp-ubl domain complex

5CTR · Squamous cell carcinoma antigen recognized by T-cells 3: “Crystal structure of human SART3 hat-C domain-human USP4 dusp-ubl domain complex”. X-ray diffraction, 12 pockets (best druggability 0.76). MolNFT v1 #115777 on GenesisL1: 3D…

PDB
5CTR
Type
protein
Length
1,031 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Squamous cell carcinoma antigen recognized by T-cells 3; Ubiquitin carboxyl-terminal…
EC
3.4.19.12
UniProt
Q15020, Q13107
Pockets
12 · best druggability 0.76

Structure

x-ray diffraction · 4 distinct chains · 56% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASquamous cell carcinoma antigen recognized by T-cells 3protein30880% helix, 0% strandQ15020
BSquamous cell carcinoma antigen recognized by T-cells 3protein30578% helix, 0% strandQ15020
CUbiquitin carboxyl-terminal hydrolase 4 (EC 3.4.19.12)protein20622% helix, 22% strandQ13107
DUbiquitin carboxyl-terminal hydrolase 4 (EC 3.4.19.12)protein21222% helix, 27% strandQ13107

Pockets

12 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17090.760.8151empty
27050.740.8070empty
311410.740.7779empty
42550.600.8032empty
52340.580.7931empty

Interfaces

3 interfaces between chains.

  • A–B · 1455 Ų buried · 33 hydrogen bonds · protein-protein
  • A–C · 752 Ų buried · 7 hydrogen bonds · protein-protein
  • B–D · 699 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5CTR · Crystal structure of human SART3 HAT-C domain-human USP4 DUSP-UBL domain complex · the same entry in another collection · chain D against D, TM-score 1.00
  • Q15020 · AlphaFold monomer V2.0 prediction for squamous cell carcinoma antigen recognized by… · a predicted model of the same protein · chain B against A, TM-score 0.98
  • Q13107 · AlphaFold monomer V2.0 prediction for ubiquitin carboxyl-terminal hydrolase 4 (Q13107) · a predicted model of the same protein · chain D against A, TM-score 0.96

Analyse

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