eF-site ID 4f7n-A
PDB Code 4f7n
Chain A

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Title Crystal structure of human CDK8/CYCC in complex with compound 11 (1-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-3-(5-hydroxypentyl)urea)
Classification TRANSFERASE/TRANSCRIPTION/INHIBITOR
Compound Cyclin-dependent kinase 8
Source Homo sapiens (Human) (CCNC_HUMAN)
Sequence A:  KMDYDFKVKLSSERERVEDLFEYEGCKVGRGTYGHVYKAK
RKDGKDDKDYALKQIEGTGISMSACREIALLRELKHPNVI
SLQKVFLSHADRKVWLLFDYAEHDLWHIIKFHRASVQLPR
GMVKSLLYQILDGIHYLHANWVLHRDLKPANILVMGEGPE
RGRVKIADMGFVVTFWYRAPELLLGARHYTKAIDIWAIGC
IFAELLTSEPIFHCRQENPYHHDQLDRIFNVMGFPADKDW
EDIKKMPEHSTLMKDFRRNTYTNCSLIKYMEKHKVKPDSK
AFHLLQKLLTMDPIKRITSEQAMQDPYFLEDPLPTSDVFA
GCQIPYPKREFLTE
Description


Functional site

1) chain A
residue 50
type
sequence A
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

2) chain A
residue 62
type
sequence S
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

3) chain A
residue 65
type
sequence R
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

4) chain A
residue 66
type
sequence E
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

5) chain A
residue 73
type
sequence L
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

6) chain A
residue 79
type
sequence I
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

7) chain A
residue 98
type
sequence D
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

8) chain A
residue 99
type
sequence Y
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

9) chain A
residue 100
type
sequence A
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

10) chain A
residue 172
type
sequence A
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

11) chain A
residue 173
type
sequence D
description BINDING SITE FOR RESIDUE 0SV A 501
source : AC1

12) chain A
residue 71
type
sequence R
description BINDING SITE FOR RESIDUE EDO A 502
source : AC2

13) chain A
residue 72
type
sequence E
description BINDING SITE FOR RESIDUE EDO A 502
source : AC2

14) chain A
residue 27
type BINDING
sequence V
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

15) chain A
residue 52
type BINDING
sequence K
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

16) chain A
residue 27-52
type prosite
sequence VGRGTYGHVYKAKRKDGKDDKDYALK
description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. VGRGTYGHVYkAkrkdgkddkd........YALK
source prosite : PS00107

17) chain A
residue 147-159
type prosite
sequence VLHRDLKPANILV
description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. VlHrDLKpaNILV
source prosite : PS00108


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