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Entry information

Complex
AACDB_ID: 6591
PDBID: 2LTQ
Chains: FE_D
Organism: Escherichia coli K-12, Mus musculus
Method: NMR
Resolution (Å):
Reference: 10.1016/j.jmb.2013.02.009
Antibody
Antibody: 2LTQ Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Disulfide bond formation protein B (DsbB)
Antigen mutation: Yes
Durg Target: P0A6M2

Sequence information

Antibody

Heavy Chain: F
Mutation: NULL

>2LTQ_F|Chain C, F|Fab fragment heavy chain|Mus musculus (10090)
EVQLVESGGGLVKPGGSLKLSCAASGFAFSSYDMSWVRQTPEKRLEWVAYISSGGGSTYYPDTVKGRFTISRDNAKNTLYLQMSSLKSEDTAMYYCARPDYRSYAMDYWGQGTSVTVSSAKTTAPSVYPLAPVCGDTTGSSVTLGCLVKGYFPEPVTLTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVTSSTWPSQSITCNVAHPASSTKVDKKIEPRGP

Light Chain: E
Mutation: NULL

>2LTQ_E|Chain B, E|Fab fragment light chain|Mus musculus (10090)
MDSQAQVLILLLLWVSGTCGDIVMSQSPSSLAVSAGEKVTMSCKSSQSLLNSRTRKNYLAWYQQKPGQSPKLLIYWASTRESGVPDRFTGSGSGTDFTLTISSVQAEDLAVYYCKQSYNLYTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Antigen

Chain: D
Mutation: C8A/C41S/C49V

>2LTQ_D|Chain A, D|Disulfide bond formation protein B|Escherichia coli (strain K12) (83333)
MLRFLNQASQGRGAWLLMAFTALALELTALWFQHVMLLKPSVLCIYERVALFGVLGAALIGAIAPKTPLRYVAMVIWLYSAFRGVQLTYEHTMLQLYPSPFATCDFMVRFPEWLPLDKWVPQVFVASGDCAERQWDFLGLEMPQWLLGIFIAYLIVAVLVVISQPFKAKKRDLFGR

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: ASN51 SER52 ARG53 THR54 LYS56 TYR58 TRP76 SER117 TYR118 ASN119 LEU120 TYR121

F: TYR50 TYR59 TYR101 ARG102 TYR104

D: MET93 LEU94 GLN95 LEU96 TYR97 PRO98 SER99 PRO100 PHE101 ALA102 THR103 GLN134

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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