Complex | |
AACDB_ID: | 3397 |
PDBID: | 7BEL |
Chains: | HL_R |
Organism: | Severe acute respiratory syndrome coronavirus 2, Homo sapiens |
Method: | XRD |
Resolution (Å): | 2.53 |
Reference: | 10.1016/j.cell.2021.02.032 |
Antibody | |
Antibody: | COVOX-88 Fab |
Antibody mutation: | No |
INN (Clinical Trial): | |
Antigen | |
Antigen: | SARS-CoV-2 Spike glycoprotein RBD |
Antigen mutation: | Yes |
Durg Target: | P0DTC2; P0DTC2; |
Antibody
Heavy Chain: H
Mutation: NULL
>7BEL_H|Chain C[auth E], H|COVOX-88 heavy chain|Homo sapiens (9606) ILFLVATATGVHSQLQLQESGPGLVKPSQTLSLTCTVSGGSISSGSYNWTWIRQPAGKGLEWIGRIYNSGSTNYNPSLKSRVTISVDTSKNQLSLKVRSVTAADTAVYYCARHCSGGTCYPKYYYGMDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDK |
Light Chain: L
Mutation: NULL
>7BEL_L|Chain D[auth F], I[auth L]|COVOX-88 light chain|Homo sapiens (9606) ILFLVATATGSWAQSALTQPPSVSEAPRQRVTISCSGSSSNIGNNAVNWYQQFPGKAPKLLIYYDDLLPSGVSDRFSGSKSGTSASLAISGVQSEDEADYYCAAWDDSLNVVVFGGGTKLTVLGQPKANPTVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHRSYSCQVTHEGSTVEKTVAPTECS |
Antigen
Chain: R
Mutation: P204K
>7BEL_R|Chain A[auth R], F[auth X]|Spike glycoprotein|Severe acute respiratory syndrome coronavirus 2 (2697049) ETGHHHHHHTNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQIAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCYFPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGKK |
Interaction
1、Solvent accessible surface areas (SASA) were calculated (Naccess V2.1.1) for each residue in antibody and antigen, respectively. The residues with SASA loss in binding of more than 1Å2 were classified as interacting residues.
Interacting residues (ΔSASA based)
H: SER33 TYR34 ASN35 TYR54 ASN55 SER102 GLY103 GLY104 THR105 LYS109 TYR111 TYR112 L: TYR51 ASP52 ASP53 LEU54 LEU55 ASP61 PHE63 SER64 GLY65 SER66 LYS67 SER68 GLY69 R: ARG403 ASP405 GLU406 ARG408 GLN409 THR415 GLY416 LYS417 TYR421 TYR453 LEU455 PHE456 TYR473 ALA475 GLU484 GLY485 PHE486 ASN487 CYS488 TYR489 PHE490 GLN493 THR500 ASN501 GLY502 TYR505 |
2、We defined interacting paratope-epitope residues by a distance cutoff of < 5Å . Two amino acids are considered as interacting residues if they have at least one atom within a distance of 5 Å from any atom.
Interacting residues (Atom distance based)