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Entry information

Complex
AACDB_ID: 4286
PDBID: 7MDU
Chains: EF_A
Organism: Macaca mulatta, Human immunodeficiency virus 1
Method: EM
Resolution (Å): 3.30
Reference: 10.1126/sciadv.abk2039
Antibody
Antibody: RM20A3 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 BG505 SOSIP MD39 envelope glycoprotein - gp120
Antigen mutation: No
Durg Target: P00750; P00750;

Sequence information

Antibody

Heavy Chain: E
Mutation: NULL

>7MDU_E|Chain C[auth E]|RM20A3 mAb Heavy Chain|Macaca mulatta (9544)
EVQLVETGGGLVQPGGSLKLSCRASGYTFSSFAMSWVRQAPGKGLEWVSLINDRGGLTFYVDSVKGRFTISRDNSKNTLSLQMHSLRDGDTAVYYCATGGMSSALQSSKYYFDFWGQGALVTVSS

Light Chain: F
Mutation: NULL

>7MDU_F|Chain D[auth F]|RM20A3 mAb Light Chain|Macaca mulatta (9544)
QSALTQPPSVSGSPGQSVTISCTGTSSDIGSYNYVSWYQQHPGKAPKLMIYDVTQRPSGVSDRFSGSKSGNTASLTISGLQADDEADYYCSAYAGRQTFYIFGGGTRLTVL

Antigen

Chain: A
Mutation: NULL

>7MDU_A|Chain B[auth A]|Surface protein gp120|Human immunodeficiency virus 1 (11676)
MKRGLCCVLLLCGAVFVSPSQEIHARFRRGARAENLWVTVYYGVPVWKDAETTLFCASDAKAYETEKHNVWATHACVPTDPNPQEIHLENVTEEFNMWKNNMVEQMHEDIISLWDQSLKPCVKLTPLCVTLQCTNVTNNITDDMRGELKNCSFNMTTELRDKKQKVYSLFYRLDVVQINENQGNRSNNSNKEYRLINCNTSAITQACPKVSFEPIPIHYCAPAGFAILKCKDKKFNGTGPCPSVSTVQCTHGIKPVVSTQLLLNGSLAEEEVIIRSENITNNAKNILVQLNTPVQINCTRPNNNTVKSIRIGPGQAFYYTGDIIGDIRQAHCNVSKATWNETLGKVVKQLRKHFGNNTIIRFAQSSGGDLEVTTHSFNCGGEFFYCNTSGLFNSTWISNTSVQGSNSTGSNDSITLPCRIKQIINMWQRIGQAMYAPPIQGVIRCVSNITGLILTRDGGSTNSTTETFRPGGGDMRDNWRSELYKYKVVKIEPLGVAPTRCKRRVVGRRRRRR

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

E: SER98 SER99

F: ARG94

A: TYR39 PRO498 THR499 ARG500 CYS501 ARG504

2、We defined interacting paratope-epitope residues by a distance cutoff of < 6 Å . Two amino acids are considered as interacting residues if they have at least one atom within a distance of 6 Å from any atom.

Interacting residues (Atom distance based)

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