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MolNFT v1 · #127920 · protein

Crystal structures of homooligomers of the non-collagenous domains of collagen type IV. ALPHA121NC1

5NAX · Collagen alpha-1(IV) chain: “Crystal structures of homooligomers of the non-collagenous domains of collagen type IV. ALPHA121NC1”. X-ray diffraction, 1 ligand (CL), 15 pockets (best druggability 0.89). MolNFT v1 #127920 on…

PDB
5NAX
Type
protein
Length
1,348 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Collagen alpha-1(IV) chain; Collagen alpha-2(IV) chain
UniProt
P02462, P08572
Ligands
CL
Pockets
15 · best druggability 0.89

Structure

x-ray diffraction · 6 distinct chains · 7% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACollagen alpha-1(IV) chainprotein2268% helix, 42% strandP02462
BCollagen alpha-1(IV) chainprotein2278% helix, 44% strandP02462
CCollagen alpha-2(IV) chainprotein2245% helix, 43% strandP08572
DCollagen alpha-1(IV) chainprotein2257% helix, 44% strandP02462
ECollagen alpha-2(IV) chainprotein2234% helix, 43% strandP08572
FCollagen alpha-1(IV) chainprotein22310% helix, 43% strandP02462

Ligands and binding sites

  • CL · Chloride ion · ion · 11 copies · chains A, D, B, C, E, F

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

15 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110540.890.90114empty
211310.870.8877empty
31000.560.8524CL
41260.540.8223CL
5960.470.8122empty

Interfaces

14 interfaces between chains.

  • A–B · 2430 Ų buried · 35 hydrogen bonds · protein-protein
  • B–C · 2354 Ų buried · 36 hydrogen bonds · protein-protein
  • E–F · 2313 Ų buried · 40 hydrogen bonds · protein-protein
  • D–F · 2283 Ų buried · 34 hydrogen bonds · protein-protein
  • A–C · 2252 Ų buried · 27 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 36 disulfide (disulfide).

Compared structures

  • 5NAX · Crystal structures of homooligomers of the non-collagenous domains of collagen type IV.… · the same entry in another collection · chain F against F, TM-score 1.00
  • P02462 · AlphaFold monomer V2.0 prediction for collagen alpha-1(IV) chain (P02462) · a predicted model of the same protein · chain F against A, TM-score 1.00
  • P08572 · AlphaFold monomer V2.0 prediction for collagen alpha-2(IV) chain (P08572) · a predicted model of the same protein · chain C against A, TM-score 1.00

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