eF-site ID 3q4c-A
PDB Code 3q4c
Chain A

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Title Crystal Structure of Wild Type BRAF kinase domain in complex with organometallic inhibitor CNS292
Classification TRANSFERASE/TRANSFERASE INHIBITOR
Compound Serine/threonine-protein kinase B-raf
Source Homo sapiens (Human) (BRAF_HUMAN)
Sequence A:  DDWEIPDGQITVGQRIGSGSFGTVYKGKWHGDVAVKMLNV
TAPTPQQLQAFKNEVGVLRKTRHVNILLFMGYSTKPQLAI
VTQWCEGSSLYHHLHIIETKFEMIKLIDIARQTAQGMDYL
HAKSIIHRDLKSNNIFLHEDLTVKIGDFGLATVKSGSILW
MAPEVIRMQDKNPYSFQSDVYAFGIVLYELMTGQLPYSNI
NNRDQIIFMVGRGYLSPDLSKVRSNCPKAMKRLMAECLKK
KRDERPLFPQILASIELLARSLPK
Description


Functional site

1) chain A
residue 462
type
sequence I
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

2) chain A
residue 530
type
sequence W
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

3) chain A
residue 531
type
sequence C
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

4) chain A
residue 533
type
sequence G
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

5) chain A
residue 534
type
sequence S
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

6) chain A
residue 538
type
sequence H
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

7) chain A
residue 582
type
sequence F
description BINDING SITE FOR RESIDUE RSW A 1
source : AC1

8) chain A
residue 575
type ACT_SITE
sequence D
description Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10027
source Swiss-Prot : SWS_FT_FI1

9) chain A
residue 462
type BINDING
sequence I
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

10) chain A
residue 482
type BINDING
sequence K
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

11) chain A
residue 670
type MOD_RES
sequence R
description Omega-N-methylarginine; by PRMT5 => ECO:0000269|PubMed:21917714
source Swiss-Prot : SWS_FT_FI6

12) chain A
residue 577
type CROSSLNK
sequence K
description Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in ubiquitin) => ECO:0000269|PubMed:23907581
source Swiss-Prot : SWS_FT_FI7

13) chain A
residue 462-482
type prosite
sequence IGSGSFGTVYKGKWHGDVAVK
description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. IGSGSFGTVYkGkwhgd.............VAVK
source prosite : PS00107

14) chain A
residue 571-583
type prosite
sequence IIHRDLKSNNIFL
description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IiHrDLKsnNIFL
source prosite : PS00108


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