eF-site ID 5a7q-AB
PDB Code 5a7q
Chain A, B

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Title Crystal structure of human JMJD2A in complex with compound 30
Classification OXIDOREDUCTASE
Compound LYSINE-SPECIFIC DEMETHYLASE 4A
Source Homo sapiens (Human) (KDM4A_HUMAN)
Sequence A:  SESETLNPSARIMTFYPTMEEFRNFSRYIAYIESQGAHRA
GLAKVVPPKEWKPRASYDDIDDLVIPAPIQQLVTGQSGLF
TQYNIQKKAMTVREFRKIANSDKYCTPRYSEFEELERKYW
KNLTFNPPIYGADVNGTLYEKHVDEWNIGRLRTILDLVEK
ESGITIEGVNTPYLYFGMWKTSFAWHTEDMDLYSINYLHF
GEPKSWYSVPPEHGKRLERLAKGFFPGSAQSCEAFLRHKM
TLISPLMLKKYGIPFDKVTQEAGEFMITFPYGYHAGFNHG
FNCAESTNFATRRWIEYGKQAVLCSCRKDMVKISMDVFVR
KFQPERYKLWKAGKDNTVIDHTLPTPEAAEF
B:  NPSARIMTFYPTMEEFRNFSRYIAYIESQGAHRAGLAKVV
PPKEWKPRASYDDIDDLVIPAPIQQLVTGQSGLFTQYNIQ
KKAMTVREFRKIANSDKYCTPRYSEFEELERKYWKNLTFN
PPIYGADVNGTLYEKHVDEWNIGRLRTILDLVEKESGITI
EGVNTPYLYFGMWKTSFAWHTEDMDLYSINYLHFGEPKSW
YSVPPEHGKRLERLAKGFFPGSAQSCEAFLRHKMTLISPL
MLKKYGIPFDKVTQEAGEFMITFPYGYHAGFNHGFNCAES
TNFATRRWIEYGKQAVLCSCRKDMVKISMDVFVRKFQPER
YKLWKAGKDNTVIDHTLPTPEAAEFL
Description


Functional site

1) chain A
residue 188
type
sequence H
description BINDING SITE FOR RESIDUE MN A 1354
source : AC1

2) chain A
residue 190
type
sequence E
description BINDING SITE FOR RESIDUE MN A 1354
source : AC1

3) chain A
residue 276
type
sequence H
description BINDING SITE FOR RESIDUE MN A 1354
source : AC1

4) chain B
residue 188
type
sequence H
description BINDING SITE FOR RESIDUE MN B 1355
source : AC2

5) chain B
residue 190
type
sequence E
description BINDING SITE FOR RESIDUE MN B 1355
source : AC2

6) chain B
residue 276
type
sequence H
description BINDING SITE FOR RESIDUE MN B 1355
source : AC2

7) chain A
residue 229
type
sequence G
description BINDING SITE FOR RESIDUE MN A 1355
source : AC3

8) chain A
residue 230
type
sequence S
description BINDING SITE FOR RESIDUE MN A 1355
source : AC3

9) chain B
residue 229
type
sequence G
description BINDING SITE FOR RESIDUE MN B 1356
source : AC4

10) chain B
residue 230
type
sequence S
description BINDING SITE FOR RESIDUE MN B 1356
source : AC4

11) chain B
residue 132
type
sequence Y
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

12) chain B
residue 185
type
sequence F
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

13) chain B
residue 188
type
sequence H
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

14) chain B
residue 190
type
sequence E
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

15) chain B
residue 198
type
sequence N
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

16) chain B
residue 206
type
sequence K
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

17) chain B
residue 208
type
sequence W
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

18) chain B
residue 241
type
sequence K
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

19) chain B
residue 276
type
sequence H
description BINDING SITE FOR RESIDUE KCH B 1357
source : AC5

20) chain A
residue 132
type
sequence Y
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

21) chain A
residue 185
type
sequence F
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

22) chain A
residue 188
type
sequence H
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

23) chain A
residue 190
type
sequence E
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

24) chain A
residue 198
type
sequence N
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

25) chain A
residue 206
type
sequence K
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

26) chain A
residue 208
type
sequence W
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

27) chain A
residue 241
type
sequence K
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

28) chain A
residue 276
type
sequence H
description BINDING SITE FOR RESIDUE KCH A 1356
source : AC6

29) chain B
residue 234
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 1358
source : AC7

30) chain B
residue 240
type
sequence H
description BINDING SITE FOR RESIDUE ZN B 1358
source : AC7

31) chain B
residue 306
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 1358
source : AC7

32) chain B
residue 308
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 1358
source : AC7

33) chain A
residue 234
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1357
source : AC8

34) chain A
residue 240
type
sequence H
description BINDING SITE FOR RESIDUE ZN A 1357
source : AC8

35) chain A
residue 306
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1357
source : AC8

36) chain A
residue 308
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1357
source : AC8

37) chain A
residue 236
type
sequence A
description BINDING SITE FOR RESIDUE CL A 1358
source : AC9

38) chain A
residue 237
type
sequence F
description BINDING SITE FOR RESIDUE CL A 1358
source : AC9

39) chain A
residue 238
type
sequence L
description BINDING SITE FOR RESIDUE CL A 1358
source : AC9

40) chain A
residue 170
type
sequence G
description BINDING SITE FOR RESIDUE CL A 1359
source : BC1

41) chain A
residue 177
type
sequence Y
description BINDING SITE FOR RESIDUE CL A 1359
source : BC1

42) chain A
residue 288
type
sequence S
description BINDING SITE FOR RESIDUE CL A 1359
source : BC1

43) chain B
residue 170
type
sequence G
description BINDING SITE FOR RESIDUE CL B 1359
source : BC2

44) chain B
residue 177
type
sequence Y
description BINDING SITE FOR RESIDUE CL B 1359
source : BC2

45) chain B
residue 288
type
sequence S
description BINDING SITE FOR RESIDUE CL B 1359
source : BC2

46) chain B
residue 18
type
sequence Y
description BINDING SITE FOR RESIDUE EDO B 1360
source : BC3

47) chain B
residue 263
type
sequence E
description BINDING SITE FOR RESIDUE EDO B 1360
source : BC3

48) chain B
residue 266
type
sequence E
description BINDING SITE FOR RESIDUE EDO B 1360
source : BC3

49) chain A
residue 170
type catalytic
sequence G
description 370
source MCSA : MCSA1

50) chain A
residue 177
type catalytic
sequence Y
description 370
source MCSA : MCSA1

51) chain A
residue 188
type catalytic
sequence H
description 370
source MCSA : MCSA1

52) chain A
residue 190
type catalytic
sequence E
description 370
source MCSA : MCSA1

53) chain A
residue 276
type catalytic
sequence H
description 370
source MCSA : MCSA1

54) chain A
residue 288
type catalytic
sequence S
description 370
source MCSA : MCSA1

55) chain B
residue 170
type catalytic
sequence G
description 370
source MCSA : MCSA2

56) chain B
residue 177
type catalytic
sequence Y
description 370
source MCSA : MCSA2

57) chain B
residue 188
type catalytic
sequence H
description 370
source MCSA : MCSA2

58) chain B
residue 190
type catalytic
sequence E
description 370
source MCSA : MCSA2

59) chain B
residue 276
type catalytic
sequence H
description 370
source MCSA : MCSA2

60) chain B
residue 288
type catalytic
sequence S
description 370
source MCSA : MCSA2

61) chain A
residue 132
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:16677698
source Swiss-Prot : SWS_FT_FI1

62) chain A
residue 198
type BINDING
sequence N
description BINDING => ECO:0000269|PubMed:16677698
source Swiss-Prot : SWS_FT_FI1

63) chain A
residue 206
type BINDING
sequence K
description BINDING => ECO:0000269|PubMed:16677698
source Swiss-Prot : SWS_FT_FI1

64) chain B
residue 132
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:16677698
source Swiss-Prot : SWS_FT_FI1

65) chain B
residue 198
type BINDING
sequence N
description BINDING => ECO:0000269|PubMed:16677698
source Swiss-Prot : SWS_FT_FI1

66) chain B
residue 206
type BINDING
sequence K
description BINDING => ECO:0000269|PubMed:16677698
source Swiss-Prot : SWS_FT_FI1

67) chain A
residue 188
type BINDING
sequence H
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00538, ECO:0000269|PubMed:16677698, ECO:0000305|PubMed:26741168
source Swiss-Prot : SWS_FT_FI2

68) chain A
residue 276
type BINDING
sequence H
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00538, ECO:0000269|PubMed:16677698, ECO:0000305|PubMed:26741168
source Swiss-Prot : SWS_FT_FI2

69) chain B
residue 188
type BINDING
sequence H
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00538, ECO:0000269|PubMed:16677698, ECO:0000305|PubMed:26741168
source Swiss-Prot : SWS_FT_FI2

70) chain B
residue 276
type BINDING
sequence H
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00538, ECO:0000269|PubMed:16677698, ECO:0000305|PubMed:26741168
source Swiss-Prot : SWS_FT_FI2

71) chain A
residue 190
type BINDING
sequence E
description BINDING => ECO:0000269|PubMed:16677698, ECO:0000305|PubMed:26741168
source Swiss-Prot : SWS_FT_FI3

72) chain B
residue 190
type BINDING
sequence E
description BINDING => ECO:0000269|PubMed:16677698, ECO:0000305|PubMed:26741168
source Swiss-Prot : SWS_FT_FI3

73) chain A
residue 234
type BINDING
sequence C
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

74) chain A
residue 240
type BINDING
sequence H
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

75) chain A
residue 306
type BINDING
sequence C
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

76) chain A
residue 308
type BINDING
sequence C
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

77) chain B
residue 234
type BINDING
sequence C
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

78) chain B
residue 240
type BINDING
sequence H
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

79) chain B
residue 306
type BINDING
sequence C
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

80) chain B
residue 308
type BINDING
sequence C
description BINDING => ECO:0007744|PDB:5F2W, ECO:0007744|PDB:5F32, ECO:0007744|PDB:5F37, ECO:0007744|PDB:5F39, ECO:0007744|PDB:5F3E, ECO:0007744|PDB:5F3G, ECO:0007744|PDB:5F5I
source Swiss-Prot : SWS_FT_FI4

81) chain A
residue 241
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:B2RXH2
source Swiss-Prot : SWS_FT_FI5

82) chain B
residue 241
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:B2RXH2
source Swiss-Prot : SWS_FT_FI5


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