PDB entry 4zji

View 4zji on RCSB PDB site
Description: PAK1 in complex with 2-chloro-5-ethyl-8-fluoro-11-(4-methylpiperazin-1-yl)-dibenzodiazepine
Class: transferase
Keywords: Inhibitor, kinase, PAK1, allosteric, transferase
Deposited on 2015-04-29, released 2015-06-24
The last revision prior to the SCOPe 2.08 freeze date was dated 2015-07-29, with a file datestamp of 2015-07-24.
Experiment type: XRAY
Resolution: 1.99 Å
R-factor: N/A
AEROSPACI score: 0.32 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Serine/threonine-protein kinase PAK 1
    Species: Homo sapiens [TaxId:9606]
    Gene: PAK1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4zjia_
  • Chain 'B':
    Compound: Serine/threonine-protein kinase PAK 1
    Species: Homo sapiens [TaxId:9606]
    Gene: PAK1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4zjib_
  • Chain 'C':
    Compound: Serine/threonine-protein kinase PAK 1
    Species: Homo sapiens [TaxId:9606]
    Gene: PAK1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4zjic_
  • Chain 'D':
    Compound: Serine/threonine-protein kinase PAK 1
    Species: Homo sapiens [TaxId:9606]
    Gene: PAK1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4zjid_
  • Heterogens: 4OQ, MG, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4zjiA (A:)
gpsdeeileklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnlqqq
pkkeliineilvmrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqi
aavcreclqaleflhsnqvihrdiksdnillgmdgsvkltdfgfcaqitpeqskrstmvg
tpywmapevvtrkaygpkvdiwslgimaiemiegeppylnenplralyliatngtpelqn
peklsaifrdflnrclemdvekrgsakellqhqflkiakplssltpliaaakeatknnh

    Sequence, based on observed residues (ATOM records): (download) 
    >4zjiA (A:)
leklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnlkeliineilv
mrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqiaavcreclqale
flhsnqvihrdiksdnillgmdgsvkltdfgfcaqitptmvgtpywmapevvtrkaygpk
vdiwslgimaiemiegeppylnenplralyliatngtpelqnpeklsaifrdflnrclem
dvekrgsakellqhqflkiakplssltpliaaakeatk

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4zjiB (B:)
gpsdeeileklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnlqqq
pkkeliineilvmrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqi
aavcreclqaleflhsnqvihrdiksdnillgmdgsvkltdfgfcaqitpeqskrstmvg
tpywmapevvtrkaygpkvdiwslgimaiemiegeppylnenplralyliatngtpelqn
peklsaifrdflnrclemdvekrgsakellqhqflkiakplssltpliaaakeatknnh

    Sequence, based on observed residues (ATOM records): (download) 
    >4zjiB (B:)
leklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnlqeliineilv
mrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqiaavcreclqale
flhsnqvihrdiksdnillgmdgsvkltdfgfcaqitptmvgtpywmapevvtrkaygpk
vdiwslgimaiemiegeppylnenplralyliatngtpelqnpeklsaifrdflnrclem
dvekrgsakellqhqflkiakplssltpliaaakea

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >4zjiC (C:)
gpsdeeileklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnlqqq
pkkeliineilvmrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqi
aavcreclqaleflhsnqvihrdiksdnillgmdgsvkltdfgfcaqitpeqskrstmvg
tpywmapevvtrkaygpkvdiwslgimaiemiegeppylnenplralyliatngtpelqn
peklsaifrdflnrclemdvekrgsakellqhqflkiakplssltpliaaakeatknnh

    Sequence, based on observed residues (ATOM records): (download) 
    >4zjiC (C:)
deeileklrsivsvgdpkkkytrfekigqgasgtvytamdatgqevaikqmnkkeliine
ilvmrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqiaavcreclq
aleflhsnqvihrdiksdnillgmdgsvkltdfgfcaqskrstmvgtpywmapevvtrka
ygpkvdiwslgimaiemiegeppylnenplralyliatngtpelqnpeklsaifrdflnr
clemdvekrgsakellqhqflkiakplssltpliaaakeat

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >4zjiD (D:)
gpsdeeileklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnlqqq
pkkeliineilvmrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqi
aavcreclqaleflhsnqvihrdiksdnillgmdgsvkltdfgfcaqitpeqskrstmvg
tpywmapevvtrkaygpkvdiwslgimaiemiegeppylnenplralyliatngtpelqn
peklsaifrdflnrclemdvekrgsakellqhqflkiakplssltpliaaakeatknnh

    Sequence, based on observed residues (ATOM records): (download) 
    >4zjiD (D:)
ileklrsivsvgdpkkkytrfekigqgasgtvytamdvatgqevaikqmnkkeliineil
vmrenknpnivnyldsylvgdelwvvmeylaggsltdvvtetcmdegqiaavcreclqal
eflhsnqvihrdiksdnillgmdgsvkltdfgfaqitskrstmvgtpywmapevvtrkay
gpkvdiwslgimaiemiegeppylnenplralyliatngtpelqnpeklsaifrdflnrc
lemdvekrgsakellqhqflkiakplssltpliaaakeat