Complex | |
AACDB_ID: | 1231 |
PDBID: | 5CJX |
Chains: | AC_K |
Organism: | Homo sapiens, Human immunodeficiency virus 1 |
Method: | XRD |
Resolution (Å): | 3.58 |
Reference: | 10.1016/j.cell.2015.08.035 |
Antibody | |
Antibody: | 8ANC195 Fab |
Antibody mutation: | No |
INN (Clinical Trial): | |
Antigen | |
Antigen: | HIV-1 BG505 SOSIP.664 gp120 |
Antigen mutation: | Yes |
Durg Target: |
Antibody
Heavy Chain: A
Mutation: NULL
>5CJX_A|Chain A, D, G[auth H]|8ANC195 G52K5 heavy chain, IG gamma-1 chain|Homo sapiens (9606) QIHLVQSGTEVKKPGSSVTVSCKAYGVNTFGLYAVNWVRQAPGQSLEYIGQIWRWKSSASHHFRGRVLISAVDLTGSSPPISSLEIKNLTSDDTAVYFCTTTSTYDRWSGLHHDGVMAFSSWGQGTLISVSAASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKTHHHHHH |
Light Chain: C
Mutation: NULL
>5CJX_C|Chain C, E, J[auth L]|8ANC195 G52K5 light chain|Homo sapiens (9606) DIQMTQSPSTLSASTGDTVRISCRASQSITGNWVAWYQQRPGKAPRLLIYRGAALLGGVPSRFRGSAAGTDFTLTIGNLQAEDFGTFYCQQYDTYPGTFGQGTKVEVKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC |
Antigen
Chain: K
Mutation: T299N/A467C
>5CJX_K|Chain F[auth G], I[auth K], L[auth Y]|BG505 Env gp120|Human immunodeficiency virus 1 (11676) NLWVTVYYGVPVWKDAETTLFCASDAKAYETEKHNVWATHACVPTDPNPQEIHLENVTEEFNMWKNNMVEQMHTDIISLWDQSLKPCVKLTPLCVTLQCTNVTNNITDDMRGELKNCSFNMTTELRDKKQKVYSLFYRLDVVQINENQGNRSNNSNKEYRLINCNTSAITQACPKVSFEPIPIHYCAPAGFAILKCKDKKFNGTGPCPSVSTVQCTHGIKPVVSTQLLLNGSLAEEEVMIRSENITNNAKNILVQFNTPVQINCTRPNNNTRKSIRIGPGQAFYATGDIIGDIRQAHCNVSKATWNETLGKVVKQLRKHFGNNTIIRFANSSGGDLEVTTHSFNCGGEFFYCNTSGLFNSTWISNTSVQGSNSTGSNDSITLPCRIKQIINMWQRIGQAMYAPPIQGVIRCVSNITGLILTRDGGSTNSTTETFRPGGGDMRDNWRSELYKYKVVKIEPLGVAPTRCKRRVVGRRRRRR |
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: ASN28 THR29 GLY31 LEU32 TRP52 ARG54 TRP55 ASP73 LEU74 THR75 GLY76 THR97 TYR98 ASP99 K: VAL44 TRP45 LYS46 ASP47 VAL89 THR90 GLU91 GLU92 PHE93 ASN94 TRP96 LYS97 ASN234 THR236 GLY237 PRO238 GLU275 ASN276 ILE277 THR278 LYS351 HIS352 PHE353 ARG456 LYS487 |
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)