eF-site ID 6md7-A
PDB Code 6md7
Chain A

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Title Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor Pyrimidinone 7
Classification HYDROLASE/HYDROLASE INHIBITOR
Compound Tyrosine-protein phosphatase non-receptor type 11
Source (PTN11_HUMAN)
Sequence A:  SRRWFHPNITGVEAENLLLTRGVDGSFLARPSKSNPGDFT
LSVRRNGAVTHIKIQNTGDYYDLYGGEKFATLAELVQYYM
EHHGQLKENGDVIELKYPLNCADPTSERWFHGHLSGKEAE
KLLTEKGKHGSFLVRESQSHPGDFVLSVRTGDNDGKSKVT
HVMIRCQELKYDVGGGERFDSLTDLVEHYKKNPMVETLGT
VLQLKQPLNTTRINAAEIESRVRELSKLQGFWEEFETLQQ
QECKLLYSRKEGQRQENKNKNRYKNILPFDHTRVVLHDGD
PPVSDYINANIIMPEKSYIATQGCLQNTVNDFWRMVFQEN
SRVIVMTTKEVERGKSKCVKYWPDEYALKEYGVMRVRNVK
ESAAHDYTLRELKLSKVGQGNTERTVWQYHFRTWPDHGVP
SDPGGVLDFLEEVHHKQESIMDAGPVVVHCSAGIGRTGTF
IVIDILIDIIREKGVDCDIDVPKTIQMVRSQRSGMVQTEA
QYRFIYMAVQHYIETL
Description


Functional site

1) chain A
residue 108
type
sequence T
description binding site for residue JE1 A 601
source : AC1

2) chain A
residue 110
type
sequence E
description binding site for residue JE1 A 601
source : AC1

3) chain A
residue 111
type
sequence R
description binding site for residue JE1 A 601
source : AC1

4) chain A
residue 113
type
sequence F
description binding site for residue JE1 A 601
source : AC1

5) chain A
residue 114
type
sequence H
description binding site for residue JE1 A 601
source : AC1

6) chain A
residue 218
type
sequence T
description binding site for residue JE1 A 601
source : AC1

7) chain A
residue 219
type
sequence T
description binding site for residue JE1 A 601
source : AC1

8) chain A
residue 250
type
sequence E
description binding site for residue JE1 A 601
source : AC1

9) chain A
residue 253
type
sequence T
description binding site for residue JE1 A 601
source : AC1

10) chain A
residue 254
type
sequence L
description binding site for residue JE1 A 601
source : AC1

11) chain A
residue 257
type
sequence Q
description binding site for residue JE1 A 601
source : AC1

12) chain A
residue 489
type
sequence D
description binding site for residue JE1 A 601
source : AC1

13) chain A
residue 492
type
sequence K
description binding site for residue JE1 A 601
source : AC1

14) chain A
residue 495
type
sequence Q
description binding site for residue JE1 A 601
source : AC1

15) chain A
residue 32
type
sequence R
description binding site for residue PO4 A 602
source : AC2

16) chain A
residue 34
type
sequence S
description binding site for residue PO4 A 602
source : AC2

17) chain A
residue 35
type
sequence K
description binding site for residue PO4 A 602
source : AC2

18) chain A
residue 36
type
sequence S
description binding site for residue PO4 A 602
source : AC2

19) chain A
residue 42
type
sequence T
description binding site for residue PO4 A 602
source : AC2

20) chain A
residue 195
type
sequence E
description binding site for residue PO4 A 603
source : AC3

21) chain A
residue 198
type
sequence K
description binding site for residue PO4 A 603
source : AC3

22) chain A
residue 257
type
sequence Q
description binding site for residue PO4 A 603
source : AC3

23) chain A
residue 260
type
sequence K
description binding site for residue PO4 A 603
source : AC3

24) chain A
residue 131
type
sequence K
description binding site for residue PO4 A 604
source : AC4

25) chain A
residue 217
type
sequence N
description binding site for residue PO4 A 604
source : AC4

26) chain A
residue 220
type
sequence R
description binding site for residue PO4 A 604
source : AC4

27) chain A
residue 492
type
sequence K
description binding site for residue PO4 A 604
source : AC4

28) chain A
residue 346
type
sequence F
description binding site for residue PO4 A 605
source : AC5

29) chain A
residue 347
type
sequence Q
description binding site for residue PO4 A 605
source : AC5

30) chain A
residue 349
type
sequence N
description binding site for residue PO4 A 605
source : AC5

31) chain A
residue 413
type
sequence R
description binding site for residue PO4 A 605
source : AC5

32) chain A
residue 62
type
sequence Y
description binding site for residue PO4 A 606
source : AC6

33) chain A
residue 70
type
sequence K
description binding site for residue PO4 A 606
source : AC6

34) chain A
residue 279
type
sequence Y
description binding site for residue PO4 A 606
source : AC6

35) chain A
residue 364
type
sequence K
description binding site for residue PO4 A 606
source : AC6

36) chain A
residue 366
type
sequence K
description binding site for residue PO4 A 606
source : AC6

37) chain A
residue 138
type
sequence R
description binding site for residue PO4 A 607
source : AC7

38) chain A
residue 140
type
sequence S
description binding site for residue PO4 A 607
source : AC7

39) chain A
residue 141
type
sequence Q
description binding site for residue PO4 A 607
source : AC7

40) chain A
residue 142
type
sequence S
description binding site for residue PO4 A 607
source : AC7

41) chain A
residue 425
type BINDING
sequence D
description BINDING => ECO:0000250
source Swiss-Prot : SWS_FT_FI2

42) chain A
residue 459
type BINDING
sequence C
description BINDING => ECO:0000250
source Swiss-Prot : SWS_FT_FI2

43) chain A
residue 506
type BINDING
sequence Q
description BINDING => ECO:0000250
source Swiss-Prot : SWS_FT_FI2

44) chain A
residue 459
type ACT_SITE
sequence C
description Phosphocysteine intermediate
source Swiss-Prot : SWS_FT_FI1

45) chain A
residue 62
type MOD_RES
sequence Y
description Phosphotyrosine => ECO:0007744|PubMed:19690332
source Swiss-Prot : SWS_FT_FI4

46) chain A
residue 66
type MOD_RES
sequence Y
description Phosphotyrosine => ECO:0000250|UniProtKB:P35235
source Swiss-Prot : SWS_FT_FI5

47) chain A
residue 457-467
type prosite
sequence VHCSAGIGRTG
description TYR_PHOSPHATASE_1 Tyrosine specific protein phosphatases active site. VHCsaGigRTG
source prosite : PS00383


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