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

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Title Structure of human PARP2 catalytic domain bound to an isoindolinone inhibitor
Classification TRANSFERASE
Compound POLY [ADP-RIBOSE] POLYMERASE 2
Source null (PARP2_HUMAN)
Sequence A:  ESQLDLRVQELIKLICNVQAMEEMMMEMKYNTKKAPLGKL
TVAQIKAGYQSLKKIEDCIRAGQHGRALMEACNEFYTRIP
HDFGLRTPPLIRTQKELSEKIQLLEALGDIEIAIKLVKTE
LQSPEHPLDQHYRNLHCALRPLDHESYEFKVISQYLQSTH
APTHSDYTMTLLDLFEVEKDGEKEAFREDLHNRMLLWHGS
RMSNWVGILSHGLRIAPPEAPITGYMFGKGIYFADMSSKS
ANYCFASRLKNTGLLLLSEVALGQCNELLEANPKAEGLLQ
GKHSTKGLGKMAPSSAHFVTLNGSTVPLGPASDTGILNGY
TLNYNEYIVYNPNQVRMRYLLKVQFNFLQLW
Description


Functional site

1) chain A
residue 328
type
sequence S
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

2) chain A
residue 331
type
sequence I
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

3) chain A
residue 332
type
sequence Q
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

4) chain A
residue 428
type
sequence H
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

5) chain A
residue 429
type
sequence G
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

6) chain A
residue 454
type
sequence G
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

7) chain A
residue 455
type
sequence Y
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

8) chain A
residue 462
type
sequence Y
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

9) chain A
residue 463
type
sequence F
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

10) chain A
residue 464
type
sequence A
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

11) chain A
residue 469
type
sequence K
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

12) chain A
residue 470
type
sequence S
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

13) chain A
residue 473
type
sequence Y
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

14) chain A
residue 558
type
sequence E
description BINDING SITE FOR RESIDUE D7N A 1584
source : AC1

15) chain A
residue 498-505
type prosite
sequence LLEANPKA
description CPSASE_2 Carbamoyl-phosphate synthase subdomain signature 2. LLEANPKA
source prosite : PS00867

16) chain A
residue 558
type ACT_SITE
sequence E
description For poly [ADP-ribose] polymerase activity => ECO:0000305|PubMed:26704974, ECO:0000305|PubMed:30104678, ECO:0000305|PubMed:32028527
source Swiss-Prot : SWS_FT_FI1

17) chain A
residue 437
type BINDING
sequence G
description BINDING => ECO:0000269|PubMed:32028527, ECO:0007744|PDB:6TX3
source Swiss-Prot : SWS_FT_FI2

18) chain A
residue 444
type BINDING
sequence R
description BINDING => ECO:0000269|PubMed:32028527, ECO:0007744|PDB:6TX3
source Swiss-Prot : SWS_FT_FI2

19) chain A
residue 470
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:32028527, ECO:0007744|PDB:6TX3
source Swiss-Prot : SWS_FT_FI2

20) chain A
residue 428
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:32028527, ECO:0007744|PDB:6TX3
source Swiss-Prot : SWS_FT_FI2

21) chain A
residue 232
type MOD_RES
sequence S
description Phosphoserine => ECO:0007744|PubMed:21406692
source Swiss-Prot : SWS_FT_FI3

22) chain A
residue 428-442
type prosite
sequence HGSRMSNWVGILSHG
description CASPASE_HIS Caspase family histidine active site. HgsrmSnwVgILSHG
source prosite : PS01121


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