eF-site ID 2ym8-A
PDB Code 2ym8
Chain A

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Title Crystal structure of checkpoint kinase 1 (Chk1) in complex with inhibitors
Classification TRANSFERASE
Compound SERINE/THREONINE-PROTEIN KINASE CHK1
Source Homo sapiens (Human) (CHK1_HUMAN)
Sequence A:  DWDLVQTLGEVQLAVNRVTEEAVAVKIVNIKKEICINKML
NHENVVKFYGHRREIQYLFLEYCSGGELFDRIEPDIGMPE
PDAQRFFHQLMAGVVYLHGIGITHRDIKPENLLLDERDNL
KISDFGLATVFRYNNRERLLNKMCGTLPYVAPELLKRREF
HAEPVDVWSCGIVLTAMLAGELPWDQPSDSCQEYSDWKEK
KTYLNPWKKIDSAPLALLHKILVENPSARITIPDIKKDRW
YNKPLK
Description


Functional site

1) chain A
residue 36
type
sequence A
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

2) chain A
residue 38
type
sequence K
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

3) chain A
residue 84
type
sequence L
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

4) chain A
residue 85
type
sequence E
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

5) chain A
residue 86
type
sequence Y
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

6) chain A
residue 87
type
sequence C
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

7) chain A
residue 134
type
sequence E
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

8) chain A
residue 135
type
sequence N
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

9) chain A
residue 137
type
sequence L
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

10) chain A
residue 147
type
sequence S
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

11) chain A
residue 148
type
sequence D
description BINDING SITE FOR RESIDUE YM8 A 1271
source : AC1

12) chain A
residue 112
type
sequence H
description BINDING SITE FOR RESIDUE EDO A 1272
source : AC2

13) chain A
residue 266
type
sequence N
description BINDING SITE FOR RESIDUE EDO A 1272
source : AC2

14) chain A
residue 129
type
sequence R
description BINDING SITE FOR RESIDUE EDO A 1273
source : AC3

15) chain A
residue 164
type
sequence L
description BINDING SITE FOR RESIDUE EDO A 1273
source : AC3

16) chain A
residue 165
type
sequence N
description BINDING SITE FOR RESIDUE EDO A 1273
source : AC3

17) chain A
residue 166
type
sequence K
description BINDING SITE FOR RESIDUE EDO A 1273
source : AC3

18) chain A
residue 123
type
sequence G
description BINDING SITE FOR RESIDUE EDO A 1274
source : AC4

19) chain A
residue 156
type
sequence R
description BINDING SITE FOR RESIDUE EDO A 1274
source : AC4

20) chain A
residue 157
type
sequence Y
description BINDING SITE FOR RESIDUE EDO A 1274
source : AC4

21) chain A
residue 158
type
sequence N
description BINDING SITE FOR RESIDUE EDO A 1274
source : AC4

22) chain A
residue 159
type
sequence N
description BINDING SITE FOR RESIDUE EDO A 1274
source : AC4

23) chain A
residue 108
type
sequence Q
description BINDING SITE FOR RESIDUE EDO A 1275
source : AC5

24) chain A
residue 267
type
sequence K
description BINDING SITE FOR RESIDUE EDO A 1275
source : AC5

25) chain A
residue 268
type
sequence P
description BINDING SITE FOR RESIDUE EDO A 1275
source : AC5

26) chain A
residue 269
type
sequence L
description BINDING SITE FOR RESIDUE EDO A 1275
source : AC5

27) chain A
residue 221
type
sequence W
description BINDING SITE FOR RESIDUE EDO A 1276
source : AC6

28) chain A
residue 224
type
sequence K
description BINDING SITE FOR RESIDUE EDO A 1276
source : AC6

29) chain A
residue 243
type
sequence H
description BINDING SITE FOR RESIDUE EDO A 1276
source : AC6

30) chain A
residue 29
type
sequence R
description BINDING SITE FOR RESIDUE EDO A 1277
source : AC7

31) chain A
residue 181
type
sequence R
description BINDING SITE FOR RESIDUE EDO A 1277
source : AC7

32) chain A
residue 249
type
sequence N
description BINDING SITE FOR RESIDUE EDO A 1277
source : AC7

33) chain A
residue 32
type
sequence E
description BINDING SITE FOR RESIDUE EDO A 1278
source : AC8

34) chain A
residue 247
type
sequence V
description BINDING SITE FOR RESIDUE EDO A 1278
source : AC8

35) chain A
residue 248
type
sequence E
description BINDING SITE FOR RESIDUE EDO A 1278
source : AC8

36) chain A
residue 249
type
sequence N
description BINDING SITE FOR RESIDUE EDO A 1278
source : AC8

37) chain A
residue 252
type
sequence A
description BINDING SITE FOR RESIDUE EDO A 1278
source : AC8

38) chain A
residue 132
type
sequence K
description BINDING SITE FOR RESIDUE EDO A 1279
source : AC9

39) chain A
residue 134
type
sequence E
description BINDING SITE FOR RESIDUE EDO A 1279
source : AC9

40) chain A
residue 116
type
sequence A
description BINDING SITE FOR RESIDUE EDO A 1280
source : BC1

41) chain A
residue 260
type
sequence K
description BINDING SITE FOR RESIDUE EDO A 1280
source : BC1

42) chain A
residue 265
type
sequence Y
description BINDING SITE FOR RESIDUE EDO A 1280
source : BC1

43) chain A
residue 130
type ACT_SITE
sequence D
description Proton acceptor
source Swiss-Prot : SWS_FT_FI1

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

45) chain A
residue 38
type BINDING
sequence K
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI2

46) chain A
residue 15-38
type prosite
sequence LGEVQLAVNRVTEEAVAVK
description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGEGAYGEVQlAvnrvteea..........VAVK
source prosite : PS00107

47) chain A
residue 126-138
type prosite
sequence ITHRDIKPENLLL
description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. ItHrDIKpeNLLL
source prosite : PS00108

48) chain A
residue 132
type CROSSLNK
sequence K
description Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in ubiquitin) => ECO:0000269|PubMed:32357935
source Swiss-Prot : SWS_FT_FI5


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