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Entry information

Complex
AACDB_ID: 6495
PDBID: 7QVK
Chains: B_A
Organism: Homo sapiens, Camelus bactrianus
Method: XRD
Resolution (Å): 3.10
Reference: 10.1371/journal.pone.0288259
Antibody
Antibody: NM-02 VH-sdAb
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Receptor tyrosine-protein kinase erbB-2 (HER-2)
Antigen mutation: No
Durg Target: P04626

Sequence information

Antibody

Chain: B
Mutation: NULL

>7QVK_B|Chain B[auth BBB]|NM-02|Camelus bactrianus (9837)
QVQLQESGGGSVQAGETLRLSCTASGFTFDDSDMGWYRQAPGNECELVSSISSDGSTYYADSVKGRFTISQDNAKNTVYLQMNSLKPEDTGVYYCAAEGHRYELGTCAALDYWGRGTQVTVSSGSGHHHHHH

Antigen

Chain: A
Mutation: NULL

>7QVK_A|Chain A[auth AAA]|Receptor tyrosine-protein kinase erbB-2|Homo sapiens (9606)
TQVCTGTDMKLRLPASPETHLDMLRHLYQGCQVVQGNLELTYLPTNASLSFLQDIQEVQGYVLIAHNQVRQVPLQRLRIVRGTQLFEDNYALAVLDNGDPLNNTTPVTGASPGGLRELQLRSLTEILKGGVLIQRNPQLCYQDTILWKDIFHKNNQLALTLIDTNRSRACHPCSPMCKGSRCWGESSEDCQSLTRTVCAGGCARCKGPLPTDCCHEQCAAGCTGPKHSDCLACLHFNHSGICELHCPALVTYNTDTFESMPNPEGRYTFGASCVTACPYNYLSTDVGSCTLVCPLHNQEVTAEDGTQRCEKCSKPCARVCYGLGMEHLREVRAVTSANIQEFAGCKKIFGSLAFLPESFDGDPASNTAPLQPEQLQVFETLEEITGYLYISAWPDSLPDLSVFQNLQVIRGRILHNGAYSLTLQGLGISWLGLRSLRELGSGLALIHHNTHLCFVHTVPWDQLFRNPHQALLHTANRPEDECVGEGLACHQLCARGHCWGPGPTQCVNCSQFLRGQECVEECRVLQGLPREYVNARHCLPCHPECQPQNGSVTCFGPEADQCVACAHYKDPPFCVARCPSGVKPDLSYMPIWKFPDEEGACQPCPINCTHSCVDLDDKGCPAEQHHHHHH

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)

B: GLN3 LEU4 PHE27 HIS100 ARG101 TYR102 GLU103 LEU104 ALA108 ALA109 LEU110 ASP111 TYR112 TRP113 ARG115

A: LYS148 LYS153 LYS178 GLY179 ARG181 GLN191 SER192 LEU193 ARG195 THR196 VAL197 CYS198 ALA199 GLY200 GLY201 CYS205 LYS206 GLY207 PRO208 LEU209 PRO210 THR211 ASP212

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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