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Entry information

Complex
AACDB_ID: 106
PDBID: 1NBY
Chains: BA_C
Organism: Mus musculus, Gallus gallus
Method: XRD
Resolution (Å): 1.80
Reference: 10.1021/bi020589+
Antibody
Antibody: HyHEL-63 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Hen Egg White Lysozyme
Antigen mutation: Yes
Durg Target:

Sequence information

Antibody

Heavy Chain: B
Mutation: NULL

>1NBY_B|Chain B|immunoglobulin gamma 1 chain|Mus musculus (10090)
EVQLQESGPSLVKPSQTLSLTCSVTGDSVTSDYWSWIRKFPGNKLEYMGYISYSGSTYYHPSLKSRISITRDTSKNQYYLQLNSVTTEDTATYYCASWGGDVWGAGTTVTVSSAKTTAPSVYPLAPVCGDTTGSSVTLGCLVKGYFPEPVTLTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVTSSTWPSQSITCNVAHPASSTKVDKKI

Light Chain: A
Mutation: NULL

>1NBY_A|Chain A|antibody kappa light chain|Mus musculus (10090)
DIVLTQSPATLSVTPGDSVSLSCRASQSISNNLHWYQQKSHESPRLLIKYASQSISGIPSRFSGSGSGTDFTLSINSVETEDFGMYFCQQSNSWPYTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Antigen

Chain: C
Mutation: K96A

>1NBY_C|Chain C|Lysozyme C|Gallus gallus (9031)
KVFGRCELAAAMKRHGLDNYRGYSLGNWVCAAKFESNFNTQATNRNTDGSTDYGILQINSRWWCNDGRTPGSRNLCNIPCSALLSSDITASVNCAAKIVSDGNGMNAWVAWRNRCKGTDVQAWIRGCRL

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)

A: SER28 SER30 ASN31 ASN32 LYS49 TYR50 GLN53 SER91 ASN92 SER93 TRP94 TYR96

B: VAL302 ASP327 THR330 SER331 ASP332 TYR333 TYR350 SER352 TYR353 SER354 SER356 TYR358 TRP398 GLY399 ASP401

C: LYS613 ARG614 HIS615 GLY616 ASP618 ASN619 TYR620 ARG621 TRP662 TRP663 ARG673 LEU675 ASN677 THR689 ASN693 ALA696 LYS697 SER700 ASP701 GLY702 ASN703 ALA707

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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