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Entry information

Complex
AACDB_ID: 7445
PDBID: 6FEQ
Chains: FE_B
Organism: Homo sapiens, Mus musculus
Method: EM
Resolution (Å): 3.60
Reference: 10.1038/s41594-018-0049-1
Antibody
Antibody: 5D3 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: ATP-binding cassette sub-family G member 2 (ABCG2)
Antigen mutation: No
Durg Target: Q9UNQ0; Q9UNQ0;

Sequence information

Antibody

Heavy Chain: F
Mutation: NULL

>6FEQ_F|Chain D, F|5D3(Fab) heavy chain variable domain|Mus musculus (10090)
QVQLQESGPGLVKPSQSLSLTCTVTGFSITSDYAWNWIRQFPGKKLEWMGYINFDGGTTYNPSLRGRISITRDTSKNQFFLQLRSVTPEDTATYYCATFYGAKGTLDYWGQGTSVTVSSAKTTPPSVYPLAPVCGDTSGSSVTLGCLVKGYFPEPVTLTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVTSSTWPSQSITCNVAHPASSTKVDKKIEPRGP

Light Chain: E
Mutation: NULL

>6FEQ_E|Chain C, E|5D3(Fab) light chain variable domain|Mus musculus (10090)
DIVLTQSPSSFSVSLGDRVTISCKASGYILNRLAWYQQKPGNAPRLLISGATSLETGFPSRFSGTGSGKDYTLSISSLQTEDVGTYYCQQYWSTPWTFGGGTKLEIRRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Antigen

Chain: B
Mutation: NULL

>6FEQ_B|Chain A, B|ATP-binding cassette sub-family G member 2|Homo sapiens (9606)
MSSSNVEVFIPVSQGNTNGFPATASNDLKAFTEGAVLSFHNICYRVKLKSGFLPCRKPVEKEILSNINGIMKPGLNAILGPTGGGKSSLLDVLAARKDPSGLSGDVLINGAPRPANFKCNSGYVVQDDVVMGTLTVRENLQFSAALRLATTMTNHEKNERINRVIQELGLDKVADSKVGTQFIRGVSGGERKRTSIGMELITDPSILFLDEPTTGLDSSTANAVLLLLKRMSKQGRTIIFSIHQPRYSIFKLFDSLTLLASGRLMFHGPAQEALGYFESAGYHCEAYNNPADFFLDIINGDSTAVALNREEDFKATEIIEPSKQDKPLIEKLAEIYVNSSFYKETKAELHQLSGGEKKKKITVFKEISYTTSFCHQLRWVSKRSFKNLLGNPQASIAQIIVTVVLGLVIGAIYFGLKNDSTGIQNRAGVLFFLTTNQCFSSVSAVELFVVEKKLFIHEYISGYYRVSSYFLGKLLSDLLPMRMLPSIIFTCIVYFMLGLKPKADAFFVMMFTLMMVAYSASSMALAIAAGQSVVSVATLLMTICFVFMMIFSGLLVNLTTIASWLSWLQYFSIPRYGFTALQHNEFLGQNFCPGLNATGNNPCNYATCTGEEYLVKQGIDLSPWGLWKNHVALACMIVIFLTIAYLKLLFLKKYS

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)

E: THR94

F: SER31 ASP32 TYR33 ALA34 TYR51 ASN53 PHE54 ASP55 GLY57 THR58 THR59 PHE99 TYR100 GLY101 ALA102

B: LYS417 ASN418 ASP419 ASN590 CYS592 PRO593 GLY594 LEU595 ASN596 PRO602 CYS603

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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