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Entry information

Complex
AACDB_ID: 3349
PDBID: 7A3U
Chains: HL_A
Organism: Zika virus, Homo sapiens
Method: XRD
Resolution (Å): 3.00
Reference: 10.1016/j.cell.2021.11.010
Antibody
Antibody: EDE1 C10 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Zika virus envelope glycoprotein E
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>7A3U_H|Chain B[auth H]|EDE1 C10 antibody divalent F(ab')2 fragment|Homo sapiens (9606)
EVQLVESGAEVKKPGASVKVSCKASGYTFTSYAMHWVRQAPGQRLEWMGWINAGNGNTKYSQKFQDRVTITRDTSASTAYMELSSLRSEDTAIYYCARDKVDDYGDYWFPTLWYFDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKTHTCPPCPPCPPLEDDDDKAGWSHPQFEKGGGS

Light Chain: L
Mutation: NULL

>7A3U_L|Chain C[auth L]|EDE1 C10 divalent F(ab')2 fragment|Homo sapiens (9606)
SQSALTQPASVSGSPGQSITISCTGTSSDVGGFNYVSWFQQHPGKAPKLMLYDVTSRPSGVSSRFSGSKSGNTASLTISGLQAEDEADYYCSSHTSRGTWVFGGGTKLTVLGQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHRSYSCQVTHEGSTVEKTVAPTECS

Antigen

Chain: A
Mutation: NULL

>7A3U_A|Chain A|Envelope protein|Zika virus (64320)
IRCIGVSNRDFVEGMSGGTWVDVVLEHGGCVTVMAQDKPTVDIELVTTTVSNMAEVRSYCYEASISDMASDSRCPTQGEAYLDKQSDTQYVCKRTLVDRGWGNGCGLFGKGSLVTCAKFACSKKMTGKSIQPENLEYRIMLSVHGSQHSGMIVNDTGHETDENRAKVEITPNSPRAEATLGGFGSLGLDCEPRTGLDFSDLYYLTMNNKHWLVHKEWFHDIPLPWHAGADTGTPHWNNKEALVEFKDAHAKRQTVVVLGSQEGAVHTALAGALEAEMDGAKGRLSSGHLKCRLKMDKLRLKGVSYSLCTAAFTFTKIPAETLHGTVTVEVQYAGTDGPCKVPAQMAVDMQTLTPVGRLITANPVITESTENSKMMLELDPPFGDSYIVIGVGEKKITHHWHRSGSTIGKGLVPR

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)

Chain residues position delta_SASA : residuesposition

H: TYR32 GLY53 ASN54 ARG94 LYS96 ASP99 ASP101 TYR102

L: ASN31 TYR49 ASP50 VAL51 THR52 SER53 ARG54 PRO55 SER56 SER60

A: ARG2 VAL6 GLY28 GLU44 VAL46 THR47 ARG138 MET140 HIS148 SER149 GLY150 MET151 ILE152 VAL153 ASN154 ARG164 ASP278 ARG283 THR315 LYS316 GLU329 GLN331 GLU370 ASN371 LYS373

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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