eF-site ID 5b25-B
PDB Code 5b25
Chain B

click to enlarge
Title Crystal structure of human PDE1B with inhibitor 3
Classification HYDROLASE/HYDROLASE INHIBITOR
Compound Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B
Source Homo sapiens (Human) (PDE1B_HUMAN)
Sequence B:  TYSTAVLNCLKNLDLWCFDVFSLNQAADDHALRTIVFELL
TRHNLISRFKIPTVFLMSFLDALETGYGKYKNPYHNQIHA
ADVTQTVHCFLLRTGMVHCLSEIELLAIIFAAAIHDYEHT
GTTNSFHIQTKSECAIVYNDRSVLENHHISSVFRLMQDDE
MNIFINLTKDEFVELRALVIEMVLATDMSCHFQQVKTMKT
ALQQLERIDKPKALSLLLHAADISHPTKQWLVHSRWTKAL
MEEFFRQGDKEAELGLPFSPLCDRTSTLVAQSQIGFIDFI
VEPTFSVLTDVAEKSVQPLAGDPNPDVVSFRSTWVKRIQE
NKQKWKERAASG
Description


Functional site

1) chain B
residue 198
type
sequence K
description binding site for residue GOL A 606
source : AC6

2) chain B
residue 227
type
sequence H
description binding site for residue ZN B 601
source : AC8

3) chain B
residue 263
type
sequence H
description binding site for residue ZN B 601
source : AC8

4) chain B
residue 264
type
sequence D
description binding site for residue ZN B 601
source : AC8

5) chain B
residue 370
type
sequence D
description binding site for residue ZN B 601
source : AC8

6) chain B
residue 264
type
sequence D
description binding site for residue MG B 602
source : AC9

7) chain B
residue 222
type
sequence Y
description binding site for residue 4QJ B 603
source : AD1

8) chain B
residue 371
type
sequence I
description binding site for residue 4QJ B 603
source : AD1

9) chain B
residue 373
type
sequence H
description binding site for residue 4QJ B 603
source : AD1

10) chain B
residue 388
type
sequence L
description binding site for residue 4QJ B 603
source : AD1

11) chain B
residue 392
type
sequence F
description binding site for residue 4QJ B 603
source : AD1

12) chain B
residue 409
type
sequence L
description binding site for residue 4QJ B 603
source : AD1

13) chain B
residue 417
type
sequence V
description binding site for residue 4QJ B 603
source : AD1

14) chain B
residue 420
type
sequence S
description binding site for residue 4QJ B 603
source : AD1

15) chain B
residue 421
type
sequence Q
description binding site for residue 4QJ B 603
source : AD1

16) chain B
residue 423
type
sequence G
description binding site for residue 4QJ B 603
source : AD1

17) chain B
residue 424
type
sequence F
description binding site for residue 4QJ B 603
source : AD1

18) chain B
residue 427
type
sequence F
description binding site for residue 4QJ B 603
source : AD1

19) chain B
residue 344
type
sequence K
description binding site for residue SO4 B 604
source : AD2

20) chain B
residue 347
type
sequence K
description binding site for residue SO4 B 604
source : AD2

21) chain B
residue 378
type
sequence W
description binding site for residue SO4 B 605
source : AD3

22) chain B
residue 499
type
sequence R
description binding site for residue SO4 B 605
source : AD3

23) chain B
residue 196
type
sequence R
description binding site for residue GOL B 606
source : AD4

24) chain B
residue 314
type
sequence N
description binding site for residue GOL B 606
source : AD4

25) chain B
residue 319
type
sequence E
description binding site for residue GOL B 606
source : AD4

26) chain B
residue 271
type
sequence T
description binding site for residue GOL B 607
source : AD5

27) chain B
residue 407
type
sequence S
description binding site for residue GOL B 607
source : AD5

28) chain B
residue 408
type
sequence P
description binding site for residue GOL B 607
source : AD5

29) chain B
residue 410
type
sequence C
description binding site for residue GOL B 607
source : AD5

30) chain B
residue 278
type
sequence T
description binding site for residue GOL B 608
source : AD6

31) chain B
residue 281
type
sequence E
description binding site for residue GOL B 608
source : AD6

32) chain B
residue 441
type
sequence E
description binding site for residue 4QJ D 603
source : AE8

33) chain B
residue 474
type
sequence P
description binding site for residue 4QJ D 603
source : AE8

34) chain B
residue 475
type
sequence N
description binding site for residue 4QJ D 603
source : AE8

35) chain B
residue 476
type
sequence P
description binding site for residue 4QJ D 603
source : AE8

36) chain B
residue 478
type
sequence V
description binding site for residue 4QJ D 603
source : AE8

37) chain B
residue 479
type
sequence V
description binding site for residue 4QJ D 603
source : AE8

38) chain B
residue 316
type
sequence T
description binding site for residue SO4 D 604
source : AE9

39) chain B
residue 318
type
sequence D
description binding site for residue SO4 D 604
source : AE9

40) chain B
residue 351
type
sequence Q
description binding site for residue SO4 D 606
source : AF2

41) chain B
residue 476
type
sequence P
description binding site for residue GOL D 607
source : AF3

42) chain B
residue 223
type ACT_SITE
sequence H
description Proton donor => ECO:0000250|UniProtKB:O76083
source Swiss-Prot : SWS_FT_FI1

43) chain B
residue 227
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:15260978, ECO:0007744|PDB:1TAZ, ECO:0007744|PDB:4NPV, ECO:0007744|PDB:4NPW
source Swiss-Prot : SWS_FT_FI2

44) chain B
residue 263
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:15260978, ECO:0007744|PDB:1TAZ, ECO:0007744|PDB:4NPV, ECO:0007744|PDB:4NPW
source Swiss-Prot : SWS_FT_FI2

45) chain B
residue 264
type BINDING
sequence D
description BINDING => ECO:0000269|PubMed:15260978, ECO:0007744|PDB:1TAZ, ECO:0007744|PDB:4NPV, ECO:0007744|PDB:4NPW
source Swiss-Prot : SWS_FT_FI2

46) chain B
residue 370
type BINDING
sequence D
description BINDING => ECO:0000269|PubMed:15260978, ECO:0007744|PDB:1TAZ, ECO:0007744|PDB:4NPV, ECO:0007744|PDB:4NPW
source Swiss-Prot : SWS_FT_FI2

47) chain B
residue 489
type MOD_RES
sequence I
description Phosphoserine => ECO:0000250|UniProtKB:Q01065
source Swiss-Prot : SWS_FT_FI3


Display surface

Download
Links