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Entry information

Complex
AACDB_ID: 4971
PDBID: 7T4G
Chains: GI_C
Organism: Simian immunodeficiency virus, Macaca mulatta
Method: EM
Resolution (Å): 3.70
Reference: 10.1038/s41467-022-32783-2
Antibody
Antibody: K11 Full-length
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Simian immunodeficiency viruses SIVmac239.K180S SOSIP envelope glycoprotein - gp120
Antigen mutation: Yes
Durg Target: P05884

Sequence information

Antibody

Heavy Chain: G
Mutation: NULL

>7T4G_G|Chain C[auth G], G[auth H], K[auth J]|K11 IgG heavy chain|Macaca mulatta (9544)
DWTWRILFLVAAATGAHSQVQLQESGPGVVRPSQTLSLTCAVSGDTVSSCCFFWTWIRQPPGKGLEWIGNIYSDNDNTNYNPSLKTRISISKDMSKNQFSLKLNSLTATDTAIYYCARESPSRGNFCYAYLYGNCPLHFDLWGQGVLVTVSSASTKGPSVFPLAPSSRSTSESTAALGCLVKDYFPEPVTVSWNSGSLTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYVCNVNHKPSNTKVDKRVEIKTCGGGSKPPTCPPCTSPELLGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSQEDPDVKFNWYVNGAEVHHAQTKPRETQYNSTYRVVSVLTVTHQDWLNGKEYTCKVSNKALPAPIQKTISKDKGQPREPQVYTLPPSREELTKNQVSLTCLVKGFYPSDIVVEWESSGQPENTYKTTPPVLDSDGSYFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK

Light Chain: I
Mutation: NULL

>7T4G_I|Chain D[auth I], H[auth K], L|K11 IgG light chain|Macaca mulatta (9544)
ETDTLLLWVLLLWVPGSTGDILLTQSPSSLSGSVGDRVTITCRASQGINSYLNWYQQKPGKAPKLLIYFANRLQSGVPSRFSGSGSGTEFTLTISSLQSEDGATYYCQQYDTFPTFGPGTKLDIKRTVAAPSVFIFPPSEDQVKSGTVSVVCLLNNFYPREASVKWKVDGALKTGNSQESVTEQDSKDNTYSLSSTLTLSSTEYQSHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: C
Mutation: K180S

>7T4G_C|Chain A, E[auth C], I[auth E]|Envelope glycoprotein gp120|Simian immunodeficiency virus (11723)
MGCLGNQLLIAILLLSVYGIYCTLYVTVFYGVPAWRNATIPLFCATKNRDTWGTTQCLPDNGDYSEMALNVTESFDAWNNTVTEQAIEDVWQLFETSIKPCVKLSPLCITMRCNKSETDRWGLTKSITTTASTTSTTASAKVDMVNETSSCIAQDNCTGLEQEQMISCKFNMTGLKRDKSKEYNETWYSADLVCEQGNNTGNESRCYMNHCNTSVIQESCDKHYWDAIRFRYCAPPGYALLRCNDTNYSGFMPKCSKVVVSSCTRMMETQTSTWFGFNGTRAENRTYIYWHGRDNRTIISLNKYYNLTMKCRRPGNKTVLPVTIMSGLVFHSQPINDRPKQAWCWFGGKWKDAIKEVKQTIVKHPRYTGTNNTDKINLTAPGGGDPEVTFMWTNCRGEFLYCKMNWFLNWVEDRNTANQKPKEQHKRNYVPCHIRQIINTWHKVGKNVYLPPREGDLTCNSTVTSLIANIDWIDGNQTNITMSAEVAELYRLELGDYKLVEITPIGLAPTSCKRYTTGGTSRRRRRR

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)

G: CYS32 ASP53 ARG99

I: ASN30 TYR32 ASP92 THR93

C: ASP245 ASN247 SER249 PHE251 MET252 PRO253 LYS254 SER256 GLY292 VAL362 LYS363 HIS364 PRO365 ARG366 TYR367 THR368

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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