PDB entry 6itm

View 6itm on RCSB PDB site
Description: crystal structure of fxr in complex with agonist xj034
Deposited on 2018-11-23, released 2019-11-27
The last revision was dated 2020-06-10, with a file datestamp of 2020-06-05.
Experiment type: XRAY
Resolution: 2.5 Å
R-factor: N/A
AEROSPACI score: 0.21 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Bile acid receptor
    Species: Homo sapiens [TaxId:9606]
    Gene: NR1H4, BAR, FXR, HRR1, RIP14
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q96RI1
      • engineered mutation (44)
      • engineered mutation (117)
  • Chain 'B':
    Compound: HD3 Peptide from Nuclear receptor coactivator 1
    Species: HOMO SAPIENS, synthetic [TaxId:9606]
    Database cross-references and differences (RAF-indexed):
  • Chain 'C':
    Compound: Bile acid receptor
    Species: Homo sapiens [TaxId:9606]
    Gene: NR1H4, BAR, FXR, HRR1, RIP14
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q96RI1
      • engineered mutation (44)
      • engineered mutation (117)
  • Chain 'D':
    Compound: HD3 Peptide from Nuclear receptor coactivator 1
    Species: HOMO SAPIENS, synthetic [TaxId:9606]
    Database cross-references and differences (RAF-indexed):
  • Heterogens: AWL, HOH

PDB Chain Sequences:
This PDB entry is not classified in SCOPe 2.08, so the chain sequences below are not included in the ASTRAL sequence sets.

  • Chain 'A':
    Sequence, based on SEQRES records:
    >6itmA (A:)
mghhhhhhgsteltpdqqtllhfimdsynkqrmpqeitnkilkeafsaeenfliltemat
nhvqvlveftkklpgfqtldhedqiallkgsaveamflrsaeifnkklpsghsdlleari
rnsgisdeyitpmfsfyksigelkmtqeeyalltaivilspdrqyikdreaveklqepll
dvlqklckihqpenpqhfacllgrltelrtfnhhhaemlmswrvndhkftpllceiwdvq

    Sequence, based on observed residues (ATOM records):
    >6itmA (A:)
eltpdqqtllhfimdsynkqrmpqeitnkilkeafsaeenfliltematnhvqvlveftk
klpgfqtldhedqiallkgsaveamflrsaeifnkklpsghsdllearirnsgisdeyit
pmfsfyksigelkmtqeeyalltaivilspdrqyikdreaveklqeplldvlqklckihq
penpqhfacllgrltelrtfnhhhaemlmswrhkftpllceiwdv

  • Chain 'B':
    Sequence, based on SEQRES records:
    >6itmB (B:)
kdhqllrylldkde

    Sequence, based on observed residues (ATOM records):
    >6itmB (B:)
dhqllrylldkd

  • Chain 'C':
    Sequence, based on SEQRES records:
    >6itmC (C:)
mghhhhhhgsteltpdqqtllhfimdsynkqrmpqeitnkilkeafsaeenfliltemat
nhvqvlveftkklpgfqtldhedqiallkgsaveamflrsaeifnkklpsghsdlleari
rnsgisdeyitpmfsfyksigelkmtqeeyalltaivilspdrqyikdreaveklqepll
dvlqklckihqpenpqhfacllgrltelrtfnhhhaemlmswrvndhkftpllceiwdvq

    Sequence, based on observed residues (ATOM records):
    >6itmC (C:)
eltpdqqtllhfimdsynkqrmpqeitnkilkeafsaeenfliltematnhvqvlveftk
klpgfqtldhedqiallkgsaveamflrsaeifnkklpsghsdllearirnsgisdeyit
pmfsfyksigelkmtqeeyalltaivilspdrqyikdreaveklqeplldvlqklckihq
penpqhfacllgrltelrtfnhhhaemlmswrvndhkftpllceiwdv

  • Chain 'D':
    Sequence, based on SEQRES records:
    >6itmD (D:)
kdhqllrylldkde

    Sequence, based on observed residues (ATOM records):
    >6itmD (D:)
dhqllrylldkd