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Entry information

Complex
AACDB_ID: 3709
PDBID: 7ELX
Chains: HL_C
Organism: Homo sapiens
Method: XRD
Resolution (Å): 2.14
Reference: Not available or To be published
Antibody
Antibody: 7ELX Fab
Antibody mutation: No
INN (Clinical Trial): Danvilostomig(Phase-II); Ipilimumab(Approved); Sovipostobart(Phase-II);
Antigen
Antigen: Cytotoxic T-lymphocyte protein 4(CTLA-4)
Antigen mutation: No
Durg Target: P16410

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>7ELX_l|Chain B[auth L], D[auth l]|light chain of Fab|Homo sapiens (9606)
METPAQLLFLLLLWLPDSTGEIVLTQSPGTLSLSPGERATLSCRASQSVGSSYLAWYQQKPGQAPRLLIYGAFSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYGSSPWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Light Chain: L
Mutation: NULL

>7ELX_h|Chain A[auth H], C[auth h]|heavy chain of Fab|Homo sapiens (9606)
MEFGLSWVFLVALLRGVQCQVQLVESGGGVVQPGRSLRLSCAASGFTFSSYTMHWVRQAPGKGLEWVTFISYDGNNKYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAIYYCARTGWLGPFDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKTHTCPPCPAPELLGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPSRDELTKVQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK

Antigen

Chain: C
Mutation: NULL

>7ELX_c|Chain E[auth C], F[auth c]|Cytotoxic T-lymphocyte protein 4|Homo sapiens (9606)
KAMHVAQPAVVLASSRGIASFVCEYASPGKATEVRVTVLRQADSQVTEVCAATYMMGNELTFLDDSICTGTSSGNQVNLTIQGLRAMDTGLYICKVELMYPPPYYLGIGNGTQIYVIDPEPCPDSD

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)

h: SER30 SER31 THR33 PHE50 SER52 TYR53 ASN56 ASN57 TYR59 THR99 GLY100 TRP101 LEU102 GLY103

l: GLY30 SER32 TYR33 TYR50 ARG55 THR57 TYR92 GLY93 SER94 SER95 TRP97

c: ALA2 MET3 GLU33 ARG35 LEU39 GLN41 SER44 VAL46 THR47 GLU48 ILE93 LYS95 GLU97 MET99 TYR100 PRO102 PRO103 TYR104 TYR105 LEU106 GLY107 ILE108

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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