eF-site ID 6a2m-B
PDB Code 6a2m
Chain B

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Title Crystal structure of wild type Plasmodium falciparum DHFR-TS complexed with BT2, NADPH, and dUMP
Classification OXIDOREDUCTASE
Compound Bifunctional dihydrofolate reductase-thymidylate synthase
Source (A7UD81_PLAFA)
Sequence B:  MMEQVCDVFDIYAICACCKVESKNEGKKNEVFNNYTFRGL
GNKGVLPWKCNSLDMKYFCAVTTYVNESKYEKLKYKRCKY
LNKETKLQNVVVMGRTSWESIPKKFKPLSNRINVILSRTL
KKEDFDEDVYIINKVEDLIVLLGKLNYYKCFIIGGSVVYQ
EFLEKKLIKKIYFTRINSTYECDVFFPEINENEYQIISVS
DVYTSNNTTLDFIIYKKTNNDDEEEDDFVYFNFNKENSIH
PNDFQIYNSLKYKYHPEYQYLNIIYDIMMNGNKQSDRTGV
GVLSKFGYIMKFDLSQYFPLLTTKKLFLRGIIEELLWFIR
GETNGNTLLNKNVRIWEANGTREFLDNRKLFHREVNDLGP
IYGFQWRHFGAEYTNMYDNYENKGVDQLKNIINLIKNDPT
SRRILLCAWNVKDLDQMALPPCHILCQFYVFDGKLSCIMY
QRSCDLGLGVPFNIASYSIFTHMIAQVCNLQPAQFIHVLG
NAHVYNNHIDSLKIQLNRIPYPFPTLKLNPDIKNIEDFTI
SDFTIQNYVHHEKISM
Description


Functional site

1) chain B
residue 470
type
sequence R
description binding site for residue UMP A 703
source : AC3

2) chain B
residue 471
type
sequence R
description binding site for residue UMP A 703
source : AC3

3) chain B
residue 14
type
sequence I
description binding site for residue 9QR B 701
source : AC5

4) chain B
residue 15
type
sequence C
description binding site for residue 9QR B 701
source : AC5

5) chain B
residue 16
type
sequence A
description binding site for residue 9QR B 701
source : AC5

6) chain B
residue 54
type
sequence D
description binding site for residue 9QR B 701
source : AC5

7) chain B
residue 55
type
sequence M
description binding site for residue 9QR B 701
source : AC5

8) chain B
residue 58
type
sequence F
description binding site for residue 9QR B 701
source : AC5

9) chain B
residue 116
type
sequence F
description binding site for residue 9QR B 701
source : AC5

10) chain B
residue 164
type
sequence I
description binding site for residue 9QR B 701
source : AC5

11) chain B
residue 170
type
sequence Y
description binding site for residue 9QR B 701
source : AC5

12) chain B
residue 185
type
sequence T
description binding site for residue 9QR B 701
source : AC5

13) chain B
residue 15
type
sequence C
description binding site for residue NAP B 702
source : AC6

14) chain B
residue 16
type
sequence A
description binding site for residue NAP B 702
source : AC6

15) chain B
residue 40
type
sequence L
description binding site for residue NAP B 702
source : AC6

16) chain B
residue 41
type
sequence G
description binding site for residue NAP B 702
source : AC6

17) chain B
residue 44
type
sequence G
description binding site for residue NAP B 702
source : AC6

18) chain B
residue 45
type
sequence V
description binding site for residue NAP B 702
source : AC6

19) chain B
residue 46
type
sequence L
description binding site for residue NAP B 702
source : AC6

20) chain B
residue 105
type
sequence G
description binding site for residue NAP B 702
source : AC6

21) chain B
residue 106
type
sequence R
description binding site for residue NAP B 702
source : AC6

22) chain B
residue 107
type
sequence T
description binding site for residue NAP B 702
source : AC6

23) chain B
residue 108
type
sequence S
description binding site for residue NAP B 702
source : AC6

24) chain B
residue 127
type
sequence L
description binding site for residue NAP B 702
source : AC6

25) chain B
residue 128
type
sequence S
description binding site for residue NAP B 702
source : AC6

26) chain B
residue 129
type
sequence R
description binding site for residue NAP B 702
source : AC6

27) chain B
residue 130
type
sequence T
description binding site for residue NAP B 702
source : AC6

28) chain B
residue 144
type
sequence N
description binding site for residue NAP B 702
source : AC6

29) chain B
residue 164
type
sequence I
description binding site for residue NAP B 702
source : AC6

30) chain B
residue 165
type
sequence G
description binding site for residue NAP B 702
source : AC6

31) chain B
residue 166
type
sequence G
description binding site for residue NAP B 702
source : AC6

32) chain B
residue 167
type
sequence S
description binding site for residue NAP B 702
source : AC6

33) chain B
residue 168
type
sequence V
description binding site for residue NAP B 702
source : AC6

34) chain B
residue 169
type
sequence V
description binding site for residue NAP B 702
source : AC6

35) chain B
residue 170
type
sequence Y
description binding site for residue NAP B 702
source : AC6

36) chain B
residue 172
type
sequence E
description binding site for residue NAP B 702
source : AC6

37) chain B
residue 345
type
sequence R
description binding site for residue UMP B 703
source : AC7

38) chain B
residue 490
type
sequence C
description binding site for residue UMP B 703
source : AC7

39) chain B
residue 491
type
sequence H
description binding site for residue UMP B 703
source : AC7

40) chain B
residue 509
type
sequence Q
description binding site for residue UMP B 703
source : AC7

41) chain B
residue 510
type
sequence R
description binding site for residue UMP B 703
source : AC7

42) chain B
residue 511
type
sequence S
description binding site for residue UMP B 703
source : AC7

43) chain B
residue 513
type
sequence D
description binding site for residue UMP B 703
source : AC7

44) chain B
residue 521
type
sequence N
description binding site for residue UMP B 703
source : AC7

45) chain B
residue 551
type
sequence H
description binding site for residue UMP B 703
source : AC7

46) chain B
residue 553
type
sequence Y
description binding site for residue UMP B 703
source : AC7

47) chain B
residue 330
type
sequence N
description binding site for residue PO4 B 704
source : AC8

48) chain B
residue 331
type
sequence I
description binding site for residue PO4 B 704
source : AC8

49) chain B
residue 334
type
sequence D
description binding site for residue PO4 B 704
source : AC8

50) chain B
residue 356
type
sequence Y
description binding site for residue PO4 B 704
source : AC8


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