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Entry information

Complex
AACDB_ID: 2291
PDBID: 6I3Z
Chains: HL_A
Organism: Homo sapiens, Mus musculus
Method: XRD
Resolution (Å): 3.10
Reference: 10.1172/jci.insight.135459
Antibody
Antibody: 2H2 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Alpha-1-antitrypsin
Antigen mutation: No
Durg Target: P01009

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>6I3Z_H|Chain C[auth H]|Fab 2H2 heavy chain|Mus musculus (10090)
EVQLEESGGGLVKPGGSLKLSCAASGFAFSIYDMSWVRQTPEKRLEWVAYISSGGGTTYYPDTVKGRFTISRDNAKNTLYLQMSSLKSEDTAIYYCARHAGVHYWGQGTTLTVSSAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPASSTKVDKKIVPRD

Light Chain: L
Mutation: NULL

>6I3Z_L|Chain D[auth L]|Fab 2H2 light chain|Mus musculus (10090)
DIVMTQSPSSMYASLGERVTITCKASQDINSYLSWFQQKPGKSPKNLIYRANRLVDGVPSRFSGSGSGQDYSLTISSLEYEDMGIYYCLQYDEFPWTFGGGTKLESKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Antigen

Chain: A
Mutation: NULL

>6I3Z_A|Chain A|Alpha-1-antitrypsin|Homo sapiens (9606)
MRGSDPQGDAAQKTDTSHHDQDHPTFNKITPNLAEFAFSLYRQLAHQSNSTNIFFSPVSIATAFAMLSLGTKADTHDEILEGLNFNLTEIPEAQIHEGFQELLRTLNQPDSQLQLTTGNGLFLSEGLKLVDKFLEDVKKLYHSEAFTVNFGDTEEAKKQINDYVEKGTQGKIVDLVKELDRDTVFALVNYIFFKGKWERPFEVKDTEEEDFHVDQVTTVKVPMMKRLGMFNIQHCKKLSSWVLLMKYLGNATAIFFLPDEGKLQHLENELTHDIITKFLENEDRRSASLHLPKLSITGTYDLKSVLGQLGITKVFSNGADLSGVTEEAPLKLSKAVHKAVLTIDEKGTEAAGAMFL

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: SER30 ILE31 TYR32 ASP33 TYR50 SER52 GLY53 GLY55 ARG94 ALA96 GLY97 VAL98

L: ASN30 TYR32 TYR49 ARG50 ARG53 ASP56 TYR91 ASP92 PHE94 TRP96

A: VAL200 LYS201 ASP202 THR203 GLU204 GLU205 GLU206 LYS217 VAL218 PRO219 LYS222 LYS290 LEU291 SER292 THR339 ASP341 GLU342 LYS343

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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