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Entry information

Complex
AACDB_ID: 7020
PDBID: 4PIR
Chains: F_E
Organism: Mus musculus, Lama glama
Method: XRD
Resolution (Å): 3.50
Reference: 10.1038/nature13552
Antibody
Antibody: 15 VHH
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: 5-hydroxytryptamine receptor 3A
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Chain: F
Mutation: NULL

>4PIR_F|Chain F, G, H, I, J|VHH15|Lama glama (9844)
DVQLVESGGGLVQPGGSLRLSCAYSGSLFSILRMDWYRQAPGKERELVAGITRDAAGYADSTNYADSVKGRFTISRDSAKNTVYLQMNSLKPEDTAVYYCNADARTITGRADYWGQGTQVTVSS

Antigen

Chain: E
Mutation: NULL

>4PIR_E|Chain A, B, C, D, E|5-hydroxytryptamine receptor 3A|Mus musculus (10090)
ATQARDTTQPALLRLSDHLLANYKKGVRPVRDWRKPTTVSIDVIMYAILNVDEKNQVLTTYIWYRQYWTDEFLQWTPEDFDNVTKLSIPTDSIWVPDILINEFVDVGKSPNIPYVYVHHRGEVQNYKPLQLVTACSLDIYNFPFDVQNCSLTFTSWLHTIQDINITLWRSPEEVRSDKSIFINQGEWELLEVFPQFKEFSIDISNSYAEMKFYVIIRRRPLFYAVSLLLPSIFLMVVDIVGFCLPPDSGERVSFKITLLLGYSVFLIIVSDTLPATAIGTPLIGVYFVVCMALLVISLAETIFIVRLVHKQDLQRPVPDWLRHLVLDRIAWILCLGEQPMAHRPPATFQANKTDDCSAMGNHCSHVGGPQDLEKTPRGRGSPLPPPREASLAVRGLLQELSSIRHFLEKRDEMREVARDWLRVGYVLDRLLFRIYLLAVLAYSITLVTLWSIWHSS

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)

F: ASP1 GLY26 SER27 LEU28 PHE29 SER30 ARG105 THR106 ILE107 GLY109 ARG110

E: THR38 SER40 TYR67 TRP68 THR69 THR84 HIS118 HIS119 ARG120 GLU122 GLN124 TRP168 ARG169 SER170 GLU173

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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