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Entry information

Complex
AACDB_ID: 3604
PDBID: 7DK2
Chains: GH_I
Organism: Homo sapiens, Severe acute respiratory syndrome coronavirus 2
Method: XRD
Resolution (Å): 3.00
Reference: Not available or To be published
Antibody
Antibody: MW07 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: SARS-CoV-2 spike glycoprotein S1
Antigen mutation: No
Durg Target: P0DTC2

Sequence information

Antibody

Heavy Chain: G
Mutation: NULL

>7DK2_G|Chain A, D, G, J|MW07 heavy chain|Homo sapiens (9606)
EVQLVESGGGLVQPGGSLRLSCAASGFTFSSYWMSWVRQAPGKGLEWVANIKQDASEKYYLDSLKGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCARDLGILWFGDYPWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSC

Light Chain: H
Mutation: NULL

>7DK2_H|Chain B, E, H, K|MW07 light chain|Homo sapiens (9606)
DIQMTQSPSSLSASVGDRVTITCRASQGISNSLAWYQQKPGKAPKLLLYAASTLESGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQFYSTPRTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: I
Mutation: NULL

>7DK2_I|Chain C, F, I, L|Spike protein S1|Severe acute respiratory syndrome coronavirus 2 (2697049)
RVQPTESIVRFPNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQIAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCYFPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNLVKNKCVNF

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)

G: GLU1 GLN3 GLY26 PHE27 THR28 SER31 TYR32 TRP33 ASN50 LYS52 GLN53 GLU57 TYR59 ARG98 LEU100 GLY101 ILE102 TRP104 ASP107

H: ASN31 SER32 LYS45 TYR49 ALA50 SER52 THR53 LEU54 GLU55 SER56 GLY57 VAL58 SER60 PHE91 TYR92 SER93 THR94 ARG96

I: ARG403 ASP405 GLU406 ARG408 GLN409 GLN414 THR415 GLY416 LYS417 ASP420 TYR421 TYR449 TYR453 LEU455 PHE456 ARG457 LYS458 TYR473 ALA475 GLY476 SER477 GLU484 GLY485 PHE486 ASN487 TYR489 PHE490 GLN493 SER494 GLY496 GLN498 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)

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