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MolNFT v1 · #18701 · protein

Crystal structure of the complex of jacalin with meso- tetrasulphonatophenylporphyrin.

1PXD · Agglutinin alpha chain: “Crystal structure of the complex of jacalin with meso- tetrasulphonatophenylporphyrin.”. X-ray diffraction, 1 ligand (SFP). MolNFT v1 #18701 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1PXD
Type
protein
Length
149 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Agglutinin alpha chain; Agglutinin beta-3 chain
UniProt
P18670, P18673
Ligands
SFP

Structure

x-ray diffraction · 2 distinct chains · 0% helix, 62% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAgglutinin alpha chainprotein1330% helix, 65% strandP18670
BAgglutinin beta-3 chainprotein160% helix, 44% strandP18673

Ligands and binding sites

  • SFP · 5,10,15,20-tetrakis(4-sulpfonatophenyl)-21H,23H-porphine · ligand · 2 copies · chains A

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

Interfaces

1 interface between chains.

  • A–B · 525 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 1PXD · Crystal structure of the complex of jacalin with meso-tetrasulphonatophenylporphyrin. · the same entry in another collection · chain A against A, TM-score 1.00
  • P18670 · AlphaFold monomer V2.0 prediction for agglutinin alpha chain (P18670) · a predicted model of the same protein · chain A against A, TM-score 1.00
  • P18673 · AlphaFold monomer V2.0 prediction for agglutinin beta-3 chain (P18673) · a predicted model of the same protein · chain B against A, TM-score 0.32

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