PDB entry 4luw

View 4luw on RCSB PDB site
Description: Structure of bovine endothelial nitric oxide synthase heme domain in complex with 6-((((3R,5S)-5-(((6-amino-4-methylpyridin-2-yl)methoxy)methyl)pyrrolidin-3-yl)oxy)methyl)-4-methylpyridin-2-amine
Class: oxidoreductase/oxidoreductase inhibitor
Keywords: nitric oxide synthase, OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex
Deposited on 2013-07-25, released 2013-10-23
The last revision prior to the SCOPe 2.08 freeze date was dated 2017-11-15, with a file datestamp of 2017-11-10.
Experiment type: XRAY
Resolution: 2.25 Å
R-factor: N/A
AEROSPACI score: 0.25 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Nitric oxide synthase, endothelial
    Species: Bos taurus [TaxId:9913]
    Gene: NOS3
    Database cross-references and differences (RAF-indexed):
    • Uniprot P29473 (Start-441)
      • conflict (59)
    Domains in SCOPe 2.08: d4luwa_
  • Chain 'B':
    Compound: Nitric oxide synthase, endothelial
    Species: Bos taurus [TaxId:9913]
    Gene: NOS3
    Database cross-references and differences (RAF-indexed):
    • Uniprot P29473 (Start-441)
      • conflict (59)
    Domains in SCOPe 2.08: d4luwb_
  • Heterogens: HEM, H4B, QJ8, ACT, GOL, ZN, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4luwA (A:)
apapatphapdhspapnsptltrppegpkfprvknwelgsitydtlcaqsqqdgpctprr
clgslvlprklqtrpspgpppaeqllsqardfinqyyssikrsgsqaheerlqeveaeva
stgtyhlreselvfgakqawrnaprcvgriqwgklqvfdardcssaqemftyicnhikya
tnrgnlrsaitvfpqrapgrgdfriwnsqlvryagyrqqdgsvrgdpanveitelciqhg
wtpgngrfdvlplllqapdeapelfvlppelvlevplehptlewfaalglrwyalpavsn
mlleigglefsaapfsgwymsteigtrnlcdphryniledvavcmdldtrttsslwkdka
aveinlavlhsfqlakvtivdhhaatvsfmkhldneqkarggcpadwawivppisgsltp
vfhqemvnyilspafryqpdpw

    Sequence, based on observed residues (ATOM records): (download) 
    >4luwA (A:)
gpkfprvknwelgsitydtlcaqsqqdgpctprrclgslvlprpaeqllsqardfinqyy
ssikrsgsqaheerlqeveaevastgtyhlreselvfgakqawrnaprcvgriqwgklqv
fdardcssaqemftyicnhikyatnrgnlrsaitvfpqrapgrgdfriwnsqlvryagyr
qqdgsvrgdpanveitelciqhgwtpgngrfdvlplllqapdeapelfvlppelvlevpl
ehptlewfaalglrwyalpavsnmlleigglefsaapfsgwymsteigtrnlcdphryni
ledvavcmdldtrttsslwkdkaaveinlavlhsfqlakvtivdhhaatvsfmkhldneq
karggcpadwawivppisgsltpvfhqemvnyilspafryqpdpw

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4luwB (B:)
apapatphapdhspapnsptltrppegpkfprvknwelgsitydtlcaqsqqdgpctprr
clgslvlprklqtrpspgpppaeqllsqardfinqyyssikrsgsqaheerlqeveaeva
stgtyhlreselvfgakqawrnaprcvgriqwgklqvfdardcssaqemftyicnhikya
tnrgnlrsaitvfpqrapgrgdfriwnsqlvryagyrqqdgsvrgdpanveitelciqhg
wtpgngrfdvlplllqapdeapelfvlppelvlevplehptlewfaalglrwyalpavsn
mlleigglefsaapfsgwymsteigtrnlcdphryniledvavcmdldtrttsslwkdka
aveinlavlhsfqlakvtivdhhaatvsfmkhldneqkarggcpadwawivppisgsltp
vfhqemvnyilspafryqpdpw

    Sequence, based on observed residues (ATOM records): (download) 
    >4luwB (B:)
kfprvknwelgsitydtlcaqsqqdgpctprrclgslvlprkpaeqllsqardfinqyys
sikrsgsqaheerlqeveaevastgtyhlreselvfgakqawrnaprcvgriqwgklqvf
dardcssaqemftyicnhikyatnrgnlrsaitvfpqrapgrgdfriwnsqlvryagyrq
qdgsvrgdpanveitelciqhgwtpgngrfdvlplllqapdeapelfvlppelvlevple
hptlewfaalglrwyalpavsnmlleigglefsaapfsgwymsteigtrnlcdphrynil
edvavcmdldtrttsslwkdkaaveinlavlhsfqlakvtivdhhaatvsfmkhldneqk
arggcpadwawivppisgsltpvfhqemvnyilspafryqpdpw