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Entry information

Complex
AACDB_ID: 98
PDBID: 1MHP
Chains: XY_B
Organism: Rattus norvegicus, Mus musculus
Method: XRD
Resolution (Å): 2.80
Reference: 10.1016/s0022-2836(03)00203-1
Antibody
Antibody: AQC2 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: integrin alpha 1, (RESIDUES 169-360)
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: X
Mutation: NULL

>1MHP_X|Chain B[auth H], E[auth X]|Fab fragment, heavy chain|Mus musculus (10090)
EVQLVESGGGLVQPGGSLRLSCAASGFTFSRYTMSWVRQAPGKGLEWVATISGGGHTYYLDSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCTRGFGDGGYFDVWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPK

Light Chain: Y
Mutation: NULL

>1MHP_Y|Chain C[auth L], F[auth Y]|FAB FRAGMENT, light chain|Mus musculus (10090)
IQLTQSPSSLSASVGDRVTITCSASSSVNHMFWYQQKPGKAPKPWIYLTSNLASGVPSRFSGSGSGTDYTLTISSLQPEDFATYYCQQWSGNPWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: B
Mutation: NULL

>1MHP_B|Chain A, D[auth B]|integrin alpha 1, (RESIDUES 169-360)|Rattus norvegicus (10116)
TQLDIVIVLDGSNSIYPWESVIAFLNDLLKRMDIGPKQTQVGIVQYGENVTHEFNLNKYSSTEEVLVAANKIVQRGGRQTMTALGIDTARKEAFTEARGARRGVKKVMVIVTDGESHDNYRLKQVIQDCEDENIQRFSIAILGHYNRGNLSTEKFVEEIKSIASEPTEKHFFNVSDELALVTIVKALGERIF

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)

X: SER30 ARG31 TYR32 THR33 TRP47 THR50 SER52 GLY53 GLY54 HIS56 TYR58 TYR59 ASN73 ARG97 PHE99 GLY100 ASP101 TYR104

Y: SER28 VAL29 ASN30 HIS31 TYR48 LEU49 SER66 GLY67 TRP90 SER91 ASN93 TRP95

B: SER156 ASN157 SER158 ILE159 TYR160 PRO161 GLU192 GLN218 ARG219 GLY220 GLY221 ARG222 GLN223 THR224 MET225 GLU259 SER260 HIS261 ASN263 TYR264 HIS288 TYR289 ARG291 GLY292 LEU294 LYS298 LEU322

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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