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Entry information

Complex
AACDB_ID: 3526
PDBID: 7CZD
Chains: A_B
Organism: Lama glama, Homo sapiens
Method: XRD
Resolution (Å): 1.64
Reference: 10.1136/jitc-2020-002131
Antibody
Antibody: PM1003 VHH
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Programmed cell death 1 ligand 1(PD-L1)
Antigen mutation: No
Durg Target: Q9NZQ7

Sequence information

Antibody

Chain: A
Mutation: NULL

>7CZD_A|Chain A, C|anti-PD-L1 VHH|Lama glama (9844)
EVQLQESGGGLVQPGGSLRLSCAASGFTFSSYWMYWLRQAPGKGLEWVSSINSDSSSTYYRDSVKGRFTISRDNAKNTLYLQMNSLKSEDTAVYYCAKDPGGYAKGQGTQVTVSSD

Antigen

Chain: B
Mutation: NULL

>7CZD_B|Chain B, D|Programmed cell death 1 ligand 1|Homo sapiens (9606)
MFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQFVHGEEDLKVQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMISYGGADYKRITVKVNAPY

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: SER31 TYR32 TRP33 TYR35 LEU37 GLY42 LYS43 GLY44 LEU45 GLU46 TRP47 SER50 SER53 TYR59 ARG61 LYS98 ASP99 PRO100 GLY101 GLY102 TYR103

B: MET18 PHE19 ALA51 ALA52 ILE54 TYR56 GLU58 ASN63 GLN66 VAL68 HIS69 ASP73 LYS75 VAL76 ARG113 MET115 ILE116 SER117 GLY119 GLY120 ALA121 ASP122 TYR123 ARG125

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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