PDB entry 3q4u

View 3q4u on RCSB PDB site
Description: Crystal structure of the ACVR1 kinase domain in complex with LDN-193189
Class: transferase
Keywords: Structural Genomics Consortium, SGC, Protein kinase, TRANSFERASE
Deposited on 2010-12-24, released 2011-02-09
The last revision prior to the SCOPe 2.03 freeze date was dated 2011-02-09, with a file datestamp of 2011-02-04.
Experiment type: XRAY
Resolution: 1.82 Å
R-factor: 0.166
AEROSPACI score: 0.53 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Activin receptor type-1
    Species: Homo sapiens [TaxId:9606]
    Gene: ACVR1, ACVRLK2
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q04771 (Start-300)
      • engineered mutation (8)
    Domains in SCOPe 2.03: d3q4ua_
  • Chain 'B':
    Compound: Activin receptor type-1
    Species: Homo sapiens [TaxId:9606]
    Gene: ACVR1, ACVRLK2
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q04771 (2-End)
      • expression tag (0-1)
      • engineered mutation (8)
    Domains in SCOPe 2.03: d3q4ub_
  • Chain 'C':
    Compound: Activin receptor type-1
    Species: Homo sapiens [TaxId:9606]
    Gene: ACVR1, ACVRLK2
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q04771 (Start-300)
      • engineered mutation (8)
    Domains in SCOPe 2.03: d3q4uc_
  • Chain 'D':
    Compound: Activin receptor type-1
    Species: Homo sapiens [TaxId:9606]
    Gene: ACVR1, ACVRLK2
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q04771 (2-300)
      • engineered mutation (8)
    Domains in SCOPe 2.03: d3q4ud_
  • Heterogens: LDN, EDO, FLC, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3q4uA (A:)
smqrtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlr
henilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglah
lhieifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgt
krymapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpnd
psfedmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltki
d

    Sequence, based on observed residues (ATOM records): (download) 
    >3q4uA (A:)
rtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlrhen
ilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglahlhi
eifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgtkry
mapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpndpsf
edmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltkid

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3q4uB (B:)
smqrtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlr
henilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglah
lhieifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgt
krymapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpnd
psfedmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltki
d

    Sequence, based on observed residues (ATOM records): (download) 
    >3q4uB (B:)
smqrtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlr
henilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglah
lhieifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgt
krymapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpnd
psfedmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltki

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >3q4uC (C:)
smqrtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlr
henilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglah
lhieifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgt
krymapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpnd
psfedmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltki
d

    Sequence, based on observed residues (ATOM records): (download) 
    >3q4uC (C:)
varditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlrhenil
gfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglahlhiei
fgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgtkryma
pevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpndpsfed
mrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltkid

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >3q4uD (D:)
smqrtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlr
henilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglah
lhieifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgt
krymapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpnd
psfedmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltki
d

    Sequence, based on observed residues (ATOM records): (download) 
    >3q4uD (D:)
qrtvarditllecvgkgrygevwrgswqgenvavkifssrdekswfretelyntvmlrhe
nilgfiasdmtsrhsstqlwlithyhemgslydylqlttldtvsclrivlsiasglahlh
ieifgtqgkpaiahrdlksknilvkkngqcciadlglavmhsqstnqldvgnnprvgtkr
ymapevldetiqvdcfdsykrvdiwafglvlwevarrmvsngivedykppfydvvpndps
fedmrkvvcvdqqrpnipnrwfsdptltslaklmkecwyqnpsarltalrikktltkid