eF-site ID 4jx7-AB
PDB Code 4jx7
Chain A, B

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Title Crystal structure of Pim1 kinase in complex with inhibitor 2-[(trans-4-aminocyclohexyl)amino]-4-{[3-(trifluoromethyl)phenyl]amino}pyrido[4,3-d]pyrimidin-5(6H)-one
Classification TRANSFERASE/TRANSFERASE INHIBITOR
Compound Serine/threonine-protein kinase pim-1
Source Homo sapiens (Human) (4JX7)
Sequence A:  PLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKD
RISDWGELPNGTRVPMEVVLLKKVSSGFSGVIRLLDWFER
PDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVL
EAVRHCHNCGVLHRDIKDENILIDLNRGELKLIDFGSGAL
LKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILL
YDMVCGDIPFEHDEEIIRGQVFFRQRVSSECQHLIRWCLA
LRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHS
B:  KRRRH
Description


Functional site

1) chain A
residue 44
type
sequence L
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

2) chain A
residue 65
type
sequence A
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

3) chain A
residue 121
type
sequence E
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

4) chain A
residue 122
type
sequence R
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

5) chain A
residue 123
type
sequence P
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

6) chain A
residue 126
type
sequence V
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

7) chain A
residue 128
type
sequence D
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

8) chain A
residue 174
type
sequence L
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

9) chain B
residue 6
type
sequence R
description BINDING SITE FOR RESIDUE 1N6 A 401
source : AC1

10) chain A
residue 76
type ACT_SITE
sequence D
description Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10027
source Swiss-Prot : SWS_FT_FI1

11) chain A
residue 44-67
type prosite
sequence LGSGGFGSVYSGIRVSDNLPVAIK
description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGSGGFGSVYsGirvsdnlp..........VAIK
source prosite : PS00107

12) chain A
residue 163-175
type prosite
sequence VLHRDIKDENILI
description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. VlHrDIKdeNILI
source prosite : PS00108

13) chain A
residue 37
type BINDING
sequence Q
description BINDING => ECO:0000305|PubMed:15525646, ECO:0000305|PubMed:15657054, ECO:0000305|PubMed:15808862
source Swiss-Prot : SWS_FT_FI2

14) chain A
residue 170
type MOD_RES
sequence D
description Phosphoserine => ECO:0000269|PubMed:15657054
source Swiss-Prot : SWS_FT_FI3


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