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Entry information

Complex
AACDB_ID: 6943
PDBID: 4LQF
Chains: HL_A
Organism: Vaccinia virus, Mus musculus
Method: XRD
Resolution (Å): 2.30
Reference: 10.1371/journal.ppat.1005148
Antibody
Antibody: A2C7 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Vaccinia virus A33
Antigen mutation: Yes
Durg Target:

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>4LQF_H|Chain B[auth H]|Murine IgG2b A2C7 Heavy chain Fab domain|Mus musculus (10090)
EVKLVESGGGLVQPGGSLTLSCATSGFTFSDYYIYWVRQTPEKRLEWVAYISNSGGNTYYSDAVKGRFTISRDNAKNTLFLQMSRLKSEDTAVYYCARQWGGAMDYWGQGTSVTVSSAKTTPPSVYPLAPGCGDTTGSSVTLGCLVKGYFPESVTVTWNSGSLSSSVHTFPALLQSGLYTMSSSVTVPSSTWPSQTVTCSVAHPASSTTVDKKLEP

Light Chain: L
Mutation: NULL

>4LQF_L|Chain C[auth L]|Murine IgG2b A2C7 Light chain Fab domain|Mus musculus (10090)
DVVMTQTPLSLPVSLGDQASISCRSSQSLIHTNGNTYLHWYLQKPGQSPKLLIYKVSNRFSGVPDRFSGSGSGTDFTLKISRVEAEDLGVYFCSQSTHIPPWTFGGGTKLEIKRADAAPTVSIFPTISEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNE

Antigen

Chain: A
Mutation: S1M/L30M/K35A/L52M

>4LQF_A|Chain A|A33R|Vaccinia virus (10245)
MSTTQYDHKESCNGLYYQGSCYILHSDYQMFSDAAANCTAESSTLPNKSDVMITWLIDYVEDTWGSDGNPITKTTSDYQDSDVSQEVRKYFCVKTMN

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: ASP31 TYR33 TYR35 TYR50 SER52 ASN57 TYR59 GLN99 TRP100 GLY101 GLY102

L: HIS31 THR32 ASN33 TYR37 LYS55 SER96 THR97 HIS98 ILE99 PRO100 TRP102

A: TYR116 GLN117 MET118 PHE119 SER120 ASP121 SER154 ASP155 GLY156 ASN157 SER169 ASP170 SER172 GLN173 GLU174 VAL175 ARG176

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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