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Entry information

Complex
AACDB_ID: 2528
PDBID: 6N8D
Chains: FE_C
Organism: Norovirus Hu/GII.4/Farmington Hills/2004/USA, Homo sapiens
Method: XRD
Resolution (Å): 3.10
Reference: 10.1016/j.immuni.2019.05.007
Antibody
Antibody: A1431 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Norovirus major capsid protein
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: F
Mutation: NULL

>6N8D_F|Chain C[auth D], F|A1431 Fab heavy chain|Homo sapiens (9606)
QVQLVQSGGGLVQPGGSLRLSCAASGFAFSNHGMHWVRQAPGKGLEWLSYISGSTGAIHYANSVKGRFTISRDNARNSLDLQMNSLGDEDTAVYYCARDGPRPDGTGYAGPSNDYWGQGTLVSVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKGLEVLFQ

Light Chain: E
Mutation: NULL

>6N8D_E|Chain B, E|A1431 Fab light chain|Homo sapiens (9606)
EIVLTQSPASLSLSPGERATLSCKASRSISIYLAWYQQKPGQAPRLLIYDASYRAIGIPARFSGSGSGTDFTLTISNLEPEDFAVYYCQHRSSWPALTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: C
Mutation: NULL

>6N8D_C|Chain A, D[auth C]|Major capsid protein|Norovirus Hu/GII.4/Farmington Hills/2004/USA (1182143)
GPSKPFTVPILTVEEMTNSRFPIPLEKLFTGPSGAFVVQPQNGRCTTDGVLLGTTQLSPVNICTFRGDVTHIAGTHNYTMNLASQNWNNYDPTEEIPAPLGTPDFVGRIQGMLTQTTRGDGSTRGHKATVSTGDVHFTPKLGSIQFNTDTNNDFETGQNTKFTPVGVVQDGNGAHQNEPQQWVLPSYSGRTGHNVHLAPAVAPTFPGEQLLFFRSTMPGCSGYPNMNLDCLLPQEWVQHFYQEAAPAQSDVALLRFVNPDTGRVLFECKLHKSGYVTVAHTGQHDLVIPPNGYFRFDSWVNQFYTLAPM

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)

E: SER28 ILE29 SER30 ILE31 TYR32 TYR49 ILE56 ARG91 SER92 SER93 TRP94

F: GLN1 VAL2 ASN31 HIS32 TYR50 THR54 ALA56 PRO97 ARG98 PRO99

C: PHE250 PRO253 SER254 GLY255 ALA256 PHE257 VAL258 ASN393 GLY394 ALA395 HIS396 GLN397 ASN398 PRO400 GLN401 GLN402 TRP403 VAL404 ARG435 TYR444 ASN446 ASN448 HIS501 THR502 GLY503 GLN504 HIS505 ASP506

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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