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MolNFT v1 · #181357 · protein

Structure of KD035, a VEGFR2 monoclonal antibody

7LSI · KD035 Fab heavy chain: “Structure of KD035, a VEGFR2 monoclonal antibody”. X-ray diffraction, 12 pockets (best druggability 0.72). MolNFT v1 #181357 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7LSI
Type
protein
Length
842 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
KD035 Fab heavy chain; KD035 Fab light chain
Pockets
12 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 9% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AKD035 Fab heavy chainprotein2099% helix, 52% strand—
BKD035 Fab heavy chainprotein2149% helix, 50% strand—
CKD035 Fab light chainprotein2108% helix, 50% strand—
DKD035 Fab light chainprotein2098% helix, 49% strand—

Pockets

12 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110300.720.7684empty
24840.690.7968empty
33390.650.8038empty
41950.580.8132empty
51990.550.7934empty

Interfaces

6 interfaces between chains.

  • B–D · 1699 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 1559 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 999 Ų buried · 7 hydrogen bonds · protein-protein
  • C–D · 317 Ų buried · 2 hydrogen bonds · protein-protein
  • B–C · 118 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 7LSI · Structure of KD035, a VEGFR2 monoclonal antibody · the same entry in another collection · chain A against A, TM-score 1.00

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