eF-site ID 4a3q-AB
PDB Code 4a3q
Chain A, B

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Title The 2.15 Angstrom resolution crystal structure of Staphylococcus aureus alanine racemase
Classification ISOMERASE
Compound ALANINE RACEMASE 1
Source null (ALR1_STAAM)
Sequence A:  SDKYYRSAYMNVDLNAVASNFKVFSTLHPNKTVMAVVKAN
AYGLGSVKVARHLMENGATFFAVATLDEAIELRMHGITAK
ILVLGVLPAKDIDKAIQHRVALTVPSKQWLKEAIKNISGE
QEKKLWLHIKLDTGMGRLGIKDTNTYQEVIEIIQQYEQLV
FEGVFTHFDMTTEQYQRFKDMVNEAIKPEYIHCQNSAGSL
LMDCQFCNAIRPGISLYGYYPSEYVQQKVKVHLKPSVQLI
ANVVQTKTTTIALLPIGYADGYLRIMQGSFVNVNGHQCEV
IGRVCMDQTIVKVPDQVKAGDSVILIDNHRESPQSVEVVA
EKQHTINYEVLCNLSRRLPRIYHDGDQRFVTNELLK
B:  SDKYYRSAYMNVDLNAVASNFKVFSTLHPNKTVMAVVKAN
AYGLGSVKVARHLMENGATFFAVATLDEAIELRMHGITAK
ILVLGVLPAKDIDKAIQHRVALTVPSKQWLKEAIKNISGE
QEKKLWLHIKLDTGMGRLGIKDTNTYQEVIEIIQQYEQLV
FEGVFTHFTTEQYQRFKDMVNEAIKPEYIHCQNSAGSLLM
DCQFCNAIRPGISLYGYYPSEYVQQKVKVHLKPSVQLIAN
VVQTKTLPTTIALLPIGYADGYLRIMQGSFVNVNGHQCEV
IGRVCMDQTIVKVPDQVKAGDSVILIDNHRESPQSVEVVA
EKQHTINYEVLCNLSRRLPRIYHDGDQRFVTNELLK
Description


Functional site

1) chain A
residue 39
type
sequence K
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

2) chain A
residue 43
type
sequence Y
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

3) chain A
residue 168
type
sequence H
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

4) chain A
residue 203
type
sequence N
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

5) chain A
residue 204
type
sequence S
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

6) chain A
residue 219
type
sequence R
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

7) chain A
residue 221
type
sequence G
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

8) chain A
residue 222
type
sequence I
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

9) chain A
residue 354
type
sequence Y
description BINDING SITE FOR RESIDUE PLP A 1039
source : AC1

10) chain A
residue 228
type
sequence Y
description BINDING SITE FOR RESIDUE SO4 A 1383
source : AC2

11) chain A
residue 234
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 A 1383
source : AC2

12) chain A
residue 240
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 1383
source : AC2

13) chain A
residue 241
type
sequence L
description BINDING SITE FOR RESIDUE SO4 A 1383
source : AC2

14) chain A
residue 336
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 1383
source : AC2

15) chain A
residue 107
type
sequence S
description BINDING SITE FOR RESIDUE SO4 A 1384
source : AC3

16) chain A
residue 108
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 1384
source : AC3

17) chain A
residue 109
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 A 1384
source : AC3

18) chain A
residue 146
type
sequence T
description BINDING SITE FOR RESIDUE SO4 A 1384
source : AC3

19) chain A
residue 48
type
sequence V
description BINDING SITE FOR RESIDUE SO4 A 1385
source : AC4

20) chain A
residue 49
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 1385
source : AC4

21) chain A
residue 52
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 1385
source : AC4

22) chain A
residue 76
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 1385
source : AC4

23) chain A
residue 335
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 1386
source : AC5

24) chain A
residue 336
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 1386
source : AC5

25) chain A
residue 337
type
sequence E
description BINDING SITE FOR RESIDUE SO4 A 1386
source : AC5

26) chain A
residue 29
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 1387
source : AC6

27) chain A
residue 30
type
sequence P
description BINDING SITE FOR RESIDUE SO4 A 1387
source : AC6

28) chain A
residue 31
type
sequence N
description BINDING SITE FOR RESIDUE SO4 A 1387
source : AC6

29) chain A
residue 32
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 1387
source : AC6

30) chain A
residue 131
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 1388
source : AC7

31) chain A
residue 138
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 1388
source : AC7

32) chain A
residue 139
type
sequence L
description BINDING SITE FOR RESIDUE SO4 A 1388
source : AC7

33) chain A
residue 168
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 1388
source : AC7

34) chain B
residue 314
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 A 1388
source : AC7

35) chain A
residue 311
type
sequence C
description BINDING SITE FOR RESIDUE ACT A 1389
source : AC8

36) chain A
residue 312
type
sequence M
description BINDING SITE FOR RESIDUE ACT A 1389
source : AC8

37) chain B
residue 39
type
sequence K
description BINDING SITE FOR RESIDUE ACT A 1389
source : AC8

38) chain B
residue 39
type
sequence K
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

39) chain B
residue 43
type
sequence Y
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

40) chain B
residue 168
type
sequence H
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

41) chain B
residue 204
type
sequence S
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

42) chain B
residue 219
type
sequence R
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

43) chain B
residue 221
type
sequence G
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

44) chain B
residue 222
type
sequence I
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

45) chain B
residue 354
type
sequence Y
description BINDING SITE FOR RESIDUE PLP B 1039
source : AC9

46) chain B
residue 228
type
sequence Y
description BINDING SITE FOR RESIDUE SO4 B 1383
source : BC1

47) chain B
residue 234
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 B 1383
source : BC1

48) chain B
residue 240
type
sequence H
description BINDING SITE FOR RESIDUE SO4 B 1383
source : BC1

49) chain B
residue 241
type
sequence L
description BINDING SITE FOR RESIDUE SO4 B 1383
source : BC1

50) chain B
residue 336
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 1383
source : BC1

51) chain B
residue 49
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 1384
source : BC2

52) chain B
residue 52
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 1384
source : BC2

53) chain B
residue 76
type
sequence H
description BINDING SITE FOR RESIDUE SO4 B 1384
source : BC2

54) chain A
residue 361
type
sequence S
description BINDING SITE FOR RESIDUE SO4 B 1385
source : BC3

55) chain A
residue 362
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 1385
source : BC3

56) chain B
residue 360
type
sequence L
description BINDING SITE FOR RESIDUE SO4 B 1385
source : BC3

57) chain B
residue 361
type
sequence S
description BINDING SITE FOR RESIDUE SO4 B 1385
source : BC3

58) chain B
residue 362
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 1385
source : BC3

59) chain B
residue 107
type
sequence S
description BINDING SITE FOR RESIDUE SO4 B 1386
source : BC4

60) chain B
residue 108
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 1386
source : BC4

61) chain B
residue 109
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 B 1386
source : BC4

62) chain B
residue 335
type
sequence H
description BINDING SITE FOR RESIDUE SO4 B 1387
source : BC5

63) chain B
residue 336
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 1387
source : BC5

64) chain B
residue 337
type
sequence E
description BINDING SITE FOR RESIDUE SO4 B 1387
source : BC5

65) chain A
residue 108
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

66) chain A
residue 112
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

67) chain B
residue 29
type
sequence H
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

68) chain B
residue 30
type
sequence P
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

69) chain B
residue 31
type
sequence N
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

70) chain B
residue 32
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

71) chain B
residue 211
type
sequence D
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

72) chain B
residue 213
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 B 1388
source : BC6

73) chain B
residue 131
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 1389
source : BC7

74) chain B
residue 138
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 1389
source : BC7

75) chain B
residue 139
type
sequence L
description BINDING SITE FOR RESIDUE SO4 B 1389
source : BC7

76) chain B
residue 168
type
sequence H
description BINDING SITE FOR RESIDUE SO4 B 1389
source : BC7

77) chain A
residue 39
type
sequence K
description BINDING SITE FOR RESIDUE ACT B 1390
source : BC8

78) chain A
residue 354
type
sequence Y
description BINDING SITE FOR RESIDUE ACT B 1390
source : BC8

79) chain B
residue 284
type
sequence Y
description BINDING SITE FOR RESIDUE ACT B 1390
source : BC8

80) chain B
residue 311
type
sequence C
description BINDING SITE FOR RESIDUE ACT B 1390
source : BC8

81) chain B
residue 312
type
sequence M
description BINDING SITE FOR RESIDUE ACT B 1390
source : BC8

82) chain B
residue 39
type ACT_SITE
sequence K
description Proton acceptor; specific for D-alanine => ECO:0000305|PubMed:22194336
source Swiss-Prot : SWS_FT_FI1

83) chain A
residue 39
type ACT_SITE
sequence K
description Proton acceptor; specific for D-alanine => ECO:0000305|PubMed:22194336
source Swiss-Prot : SWS_FT_FI1

84) chain B
residue 138
type BINDING
sequence R
description BINDING => ECO:0000255|HAMAP-Rule:MF_01201
source Swiss-Prot : SWS_FT_FI3

85) chain A
residue 138
type BINDING
sequence R
description BINDING => ECO:0000255|HAMAP-Rule:MF_01201
source Swiss-Prot : SWS_FT_FI3

86) chain B
residue 312
type BINDING
sequence M
description BINDING => ECO:0000305
source Swiss-Prot : SWS_FT_FI4

87) chain A
residue 312
type BINDING
sequence M
description BINDING => ECO:0000305
source Swiss-Prot : SWS_FT_FI4

88) chain A
residue 36-46
type prosite
sequence AVVKANAYGLG
description ALANINE_RACEMASE Alanine racemase pyridoxal-phosphate attachment site. AVvKANAYGLG
source prosite : PS00395

89) chain A
residue 39
type MOD_RES
sequence K
description N6-(pyridoxal phosphate)lysine
source Swiss-Prot : SWS_FT_FI5

90) chain B
residue 39
type MOD_RES
sequence K
description N6-(pyridoxal phosphate)lysine
source Swiss-Prot : SWS_FT_FI5


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