Details

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Entry information

Complex
AACDB_ID: 6120
PDBID: 8EEE
Chains: AB_Z
Organism: Zika virus ZIKV/H. sapiens/FrenchPolynesia/10087PF/2013, Macaca mulatta
Method: XRD
Resolution (Å): 2.82
Reference: 10.1016/j.celrep.2023.112942
Antibody
Antibody: rhMZ104-D Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: ZIKV virus envelope glycoprotein
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: A
Mutation: NULL

>8EEE_A|Chain D[auth A], E[auth H]|rhMZ104-D antibody heavy chain|Macaca mulatta (9544)
EVQLVESGGGLAKPGGSLRLSCAASGFTFSDYYMDWVRQAPGKGLEWVSRISNGGGSTWYADSVKGRFTISRENAKNTLYLQMNSLRAEDTAVYYCARERYCSGGVCYAGTKYFDYWGQGVLVTVSSASTKGPSVFPLAPSSRSTSESTAALGCLVKDYFPEPVTVSWNSGSLTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYVCNVNHKPSNTKVDKRVEIK

Light Chain: B
Mutation: NULL

>8EEE_B|Chain C[auth B], F[auth L]|rhMZ104-D antibody light chain|Macaca mulatta (9544)
QPVLTQPPSLSASPGASARLPCTLSSDLSVGSKNMYWYQQKPGSAPRLFLYYYSDSDKQLGPGVPNRVSGSKETSSNTAFLLISGLQPEDEADYYCQVYDSSANWVFGGGTRLTVLGQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVEVAWKADGSAVNAGVETTKPSKQSNNKYAASSYLSLTSDQWKSHKSYSCQVTHEGSTVEKTVAPAE

Antigen

Chain: Z
Mutation: NULL

>8EEE_Z|Chain A[auth E], B[auth Z]|Envelope protein E|Zika virus ZIKV/H. sapiens/FrenchPolynesia/10087PF/2013 (2043570)
IRCIGVSNRDFVEGMSGGTWVDVVLEHGGCVTVMAQDKPTVDIELVTTTVSNMAEVRSYCYEASISDMASDSRCPTQGEAYLDKQSDTQYVCKRTLVDRGWGNGCGLFGKGSLVTCAKFACSKKMTGKSIQPENLEYRIMLSVHGSQHSGMIVNDTGHETDENRAKVEITPNSPRAEATLGGFGSLGLDCEPRTGLDFSDLYYLTMNNKHWLVHKEWFHDIPLPWHAGADTGTPHWNNKEALVEFKDAHAKRQTVVVLGSQEGAVHTALAGALEAEMDGAKGRLSSGHLKCRLKMDKLRLKGVSYSLCTAAFTFTKIPAETLHGTVTVEVQYAGTDGPCKVPAQMAVDMQTLTPVGRLITANPVITESTENSKMMLELDPPFGDSYIVIGVGEKKITHHWHRSGS

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)

A: SER103 GLY105 VAL106 CYS107 TYR108 ALA109 GLY110 LYS112

B: ASP27 LEU28 GLY31 SER32 LYS33 ASN34 TYR53 SER56 ASP57 TYR99 ASP100 SER101 SER102

Z: ASP67 ALA69 SER70 ASP71 ARG73 GLN77 GLU79 TYR81 LEU82 ASP83 LYS84 GLN85 SER86 ASP87 THR88 GLN89 TYR90 LYS118 THR233

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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