ID 4RLTA STANDARD; PRT; 158 AA. DT CONVERTED FROM PDB (SEQRES) 4RLT DE (3R)-hydroxyacyl-ACP dehydratase subunit HadA OS Mycobacterium tuberculosis H37Rv CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.050 CC R-Factor 0.159 FT #SUB 24 24 LYS A 38 33 VAL B Protein S 4 FT #SUB 27 27 GLU A 38 33 VAL B Protein S 5 FT #SUB 28 28 TYR A 35 30 TYR B Protein S 7 FT #SUB 28 28 TYR A 65 60 MET B Protein S 1 FT #SUB 31 31 ALA A 34 29 ASN B Protein A 2 FT #SUB 31 31 ALA A 66 61 LEU B Protein B 1 FT #SUB 32 32 VAL A 35 30 TYR B Protein S 1 FT #SUB 32 32 VAL A 66 61 LEU B Protein S 1 FT #SUB 32 32 VAL A 69 64 GLY B Protein S 1 FT #SUB 32 32 VAL A 70 65 ILE B Protein A 6 FT #SUB 33 33 GLN A 25 20 TYR B Protein A 3 FT #SUB 33 33 GLN A 26 21 PRO B Protein S 4 FT #SUB 33 33 GLN A 27 22 LEU B Protein S 1 FT #SUB 33 33 GLN A 70 65 ILE B Protein S 1 FT #SUB 34 34 ASN A 69 64 GLY B Protein S 4 FT #SUB 34 34 ASN A 73 68 GLY B Protein S 6 FT #SUB 36 36 ASP A 77 72 SER B Protein S 7 FT #SUB 38 38 TRP A 76 71 THR B Protein S 1 FT #SUB 38 38 TRP A 80 75 GLY B Protein S 4 FT #SUB 38 38 TRP A 82 77 PRO B Protein S 6 FT #SUB 39 39 TYR A 76 71 THR B Protein S 2 FT #SUB 39 39 TYR A 82 77 PRO B Protein S 2 FT #SUB 47 47 GLU A 4 -1 GLY B Protein B 3 FT #SUB 48 48 LEU A 4 -1 GLY B Protein B 3 FT #SUB 48 48 LEU A 80 75 GLY B Protein S 1 FT #SUB 48 48 LEU A 81 76 ASP B Protein S 2 FT #SUB 49 49 GLY A 4 -1 GLY B Protein B 1 FT #SUB 50 50 TYR A 81 76 ASP B Protein S 5 FT #SUB 50 50 TYR A 83 78 GLY B Protein S 3 FT #SUB 54 54 LEU A 82 77 PRO B Protein S 2 FT #SUB 57 57 LEU A 72 67 GLY B Protein S 2 FT #SUB 57 57 LEU A 76 71 THR B Protein S 3 FT #SUB 57 57 LEU A 88 83 TYR B Protein S 1 FT #SUB 58 58 THR A 65 60 MET B Protein S 2 FT #SUB 58 58 THR A 68 63 MET B Protein S 2 FT #SUB 58 58 THR A 69 64 GLY B Protein S 3 FT #SUB 61 61 CYS A 35 30 TYR B Protein S 1 FT #SUB 62 62 VAL A 39 34 SER B Protein S 1 FT #SUB 65 65 TYR A 40 35 GLY B Protein S 1 FT #SUB 65 65 TYR A 41 36 ASP B Protein S 3 FT #SUB 81 81 GLU A 43 38 ASN B Protein A 12 FT #SUB 81 81 GLU A 44 39 PRO B Protein S 1 FT #SUB 86 86 GLN A 65 60 MET B Protein S 3 FT #SUB 86 86 GLN A 92 87 PHE B Protein A 5 FT #SUB 87 87 VAL A 91 86 ARG B Protein B 4 FT #SUB 87 87 VAL A 92 87 PHE B Protein B 7 FT #SUB 88 88 ASP A 90 85 VAL B Protein A 5 FT #SUB 88 88 ASP A 91 86 ARG B Protein S 4 FT #SUB 88 88 ASP A 92 87 PHE B Protein B 1 FT #SUB 88 88 ASP A 139 134 ARG B Protein S 6 FT #SUB 89 89 GLN A 68 63 MET B Protein A 5 FT #SUB 89 89 GLN A 89 84 ASN B Protein B 3 FT #SUB 89 89 GLN A 90 85 VAL B Protein B 5 FT #SUB 90 90 VAL A 88 83 TYR B Protein B 1 FT #SUB 90 90 VAL A 89 84 ASN B Protein A 4 FT #SUB 90 90 VAL A 139 134 ARG B Protein S 1 FT #SUB 91 91 LEU A 68 63 MET B Protein S 1 FT #SUB 91 91 LEU A 87 82 GLU B Protein B 3 FT #SUB 91 91 LEU A 88 83 TYR B Protein A 7 FT #SUB 91 91 LEU A 89 84 ASN B Protein B 2 FT #SUB 92 92 LYS A 86 81 THR B Protein B 2 FT #SUB 93 93 PHE A 85 80 VAL B Protein S 6 FT #SUB 93 93 PHE A 86 81 THR B Protein A 8 FT #SUB 93 93 PHE A 87 82 GLU B Protein S 3 FT #SUB 93 93 PHE A 88 83 TYR B Protein S 2 FT #SUB 96 96 PRO A 83 78 GLY B Protein S 1 FT #HET 55 55 ALA A 2 202 GOL A A 7 FT #HET 56 56 PRO A 2 202 GOL A B 3 FT #HET 57 57 LEU A 2 202 GOL A S 1 FT #HET 58 58 THR A 1 201 FSE A B 2 FT #HET 60 60 ILE A 1 201 FSE A A 2 FT #HET 61 61 CYS A 1 201 FSE A A 13 FT #HET 64 64 GLY A 1 201 FSE A B 7 FT #HET 65 65 TYR A 1 201 FSE A A 9 FT #HET 68 68 GLN A 1 201 FSE A S 12 FT #HET 86 86 GLN A 1 201 FSE A S 7 FT #HET 89 89 GLN A 1 201 FSE A S 9 FT #HET 91 91 LEU A 1 201 FSE A S 4 FT #HET 93 93 PHE A 2 202 GOL A S 4 FT #HET 95 95 LYS A 2 202 GOL A B 2 FT #HET 96 96 PRO A 2 202 GOL A B 5 FT #HET 97 97 ILE A 2 202 GOL A A 12 FT #HET 125 125 ASN A 1 201 FSE A S 4 FT #HET 136 136 GLN A 2 202 GOL A S 1 FT #HET 140 140 THR A 1 201 FSE A S 9 FT #HET 142 142 LEU A 1 201 FSE A S 3 FT DISORDER 148 149 FT DISORDER 158 158 CC SEQUENCE 155 AA (ATOM); CC VALSADIVGM HYRYPDHYEV EREKIREYAV AVQNDDAWYF EEDGAAELGY KGLLAPLTFI CC CVFGYKAQAA FFKHANIATA EAQIVQVDQV LKFEKPIVAG DKLYCDVYVD SVREAHGTQI CC IVTKNIVTNE EGDLVQETYT TLAGRAGGEG FSDGA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VALSADIVGMHYRYPDHYEVEREKIREYAVAVQNDDAWYFEEDGAAELGY CC ATOM VALSADIVGMHYRYPDHYEVEREKIREYAVAVQNDDAWYFEEDGAAELGY CC ************************************************** CC SEQRES KGLLAPLTFICVFGYKAQAAFFKHANIATAEAQIVQVDQVLKFEKPIVAG CC ATOM KGLLAPLTFICVFGYKAQAAFFKHANIATAEAQIVQVDQVLKFEKPIVAG CC ************************************************** CC SEQRES DKLYCDVYVDSVREAHGTQIIVTKNIVTNEEGDLVQETYTTLAGRAGEDG CC ATOM DKLYCDVYVDSVREAHGTQIIVTKNIVTNEEGDLVQETYTTLAGRAG--G CC *********************************************** * CC SEQRES EGFSDGAA CC ATOM EGFSDGA- CC ******* SQ SEQUENCE 158 AA; MW; CN; VALSADIVGM HYRYPDHYEV EREKIREYAV AVQNDDAWYF EEDGAAELGY KGLLAPLTFI CVFGYKAQAA FFKHANIATA EAQIVQVDQV LKFEKPIVAG DKLYCDVYVD SVREAHGTQI IVTKNIVTNE EGDLVQETYT TLAGRAGEDG EGFSDGAA // ID 4RLTB STANDARD; PRT; 147 AA. DT CONVERTED FROM PDB (SEQRES) 4RLT DE (3R)-hydroxyacyl-ACP dehydratase subunit HadB OS Mycobacterium tuberculosis H37Rv CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.050 CC R-Factor 0.159 FT #SUB 4 -1 GLY B 47 47 GLU A Protein B 3 FT #SUB 4 -1 GLY B 48 48 LEU A Protein B 3 FT #SUB 4 -1 GLY B 49 49 GLY A Protein B 1 FT #SUB 25 20 TYR B 33 33 GLN A Protein S 3 FT #SUB 26 21 PRO B 33 33 GLN A Protein A 4 FT #SUB 27 22 LEU B 33 33 GLN A Protein S 1 FT #SUB 34 29 ASN B 31 31 ALA A Protein S 2 FT #SUB 35 30 TYR B 28 28 TYR A Protein S 7 FT #SUB 35 30 TYR B 32 32 VAL A Protein S 1 FT #SUB 35 30 TYR B 61 61 CYS A Protein S 1 FT #SUB 38 33 VAL B 24 24 LYS A Protein B 4 FT #SUB 38 33 VAL B 27 27 GLU A Protein A 5 FT #SUB 39 34 SER B 62 62 VAL A Protein B 1 FT #SUB 40 35 GLY B 65 65 TYR A Protein B 1 FT #SUB 41 36 ASP B 65 65 TYR A Protein A 3 FT #SUB 43 38 ASN B 81 81 GLU A Protein A 12 FT #SUB 44 39 PRO B 81 81 GLU A Protein S 1 FT #SUB 65 60 MET B 28 28 TYR A Protein B 1 FT #SUB 65 60 MET B 58 58 THR A Protein S 2 FT #SUB 65 60 MET B 86 86 GLN A Protein S 3 FT #SUB 66 61 LEU B 31 31 ALA A Protein S 1 FT #SUB 66 61 LEU B 32 32 VAL A Protein S 1 FT #SUB 68 63 MET B 58 58 THR A Protein A 2 FT #SUB 68 63 MET B 89 89 GLN A Protein S 5 FT #SUB 68 63 MET B 91 91 LEU A Protein S 1 FT #SUB 69 64 GLY B 32 32 VAL A Protein B 1 FT #SUB 69 64 GLY B 34 34 ASN A Protein B 4 FT #SUB 69 64 GLY B 58 58 THR A Protein B 3 FT #SUB 70 65 ILE B 32 32 VAL A Protein A 6 FT #SUB 70 65 ILE B 33 33 GLN A Protein S 1 FT #SUB 72 67 GLY B 57 57 LEU A Protein B 2 FT #SUB 73 68 GLY B 34 34 ASN A Protein B 6 FT #SUB 76 71 THR B 38 38 TRP A Protein B 1 FT #SUB 76 71 THR B 39 39 TYR A Protein S 2 FT #SUB 76 71 THR B 57 57 LEU A Protein S 3 FT #SUB 77 72 SER B 36 36 ASP A Protein A 7 FT #SUB 80 75 GLY B 38 38 TRP A Protein B 4 FT #SUB 80 75 GLY B 48 48 LEU A Protein B 1 FT #SUB 81 76 ASP B 48 48 LEU A Protein S 2 FT #SUB 81 76 ASP B 50 50 TYR A Protein S 5 FT #SUB 82 77 PRO B 38 38 TRP A Protein S 6 FT #SUB 82 77 PRO B 39 39 TYR A Protein S 2 FT #SUB 82 77 PRO B 54 54 LEU A Protein S 2 FT #SUB 83 78 GLY B 50 50 TYR A Protein B 3 FT #SUB 83 78 GLY B 96 96 PRO A Protein B 1 FT #SUB 85 80 VAL B 93 93 PHE A Protein A 6 FT #SUB 86 81 THR B 92 92 LYS A Protein B 2 FT #SUB 86 81 THR B 93 93 PHE A Protein B 8 FT #SUB 87 82 GLU B 91 91 LEU A Protein A 3 FT #SUB 87 82 GLU B 93 93 PHE A Protein B 3 FT #SUB 88 83 TYR B 57 57 LEU A Protein S 1 FT #SUB 88 83 TYR B 90 90 VAL A Protein B 1 FT #SUB 88 83 TYR B 91 91 LEU A Protein B 7 FT #SUB 88 83 TYR B 93 93 PHE A Protein A 2 FT #SUB 89 84 ASN B 89 89 GLN A Protein A 3 FT #SUB 89 84 ASN B 90 90 VAL A Protein S 4 FT #SUB 89 84 ASN B 91 91 LEU A Protein S 2 FT #SUB 90 85 VAL B 88 88 ASP A Protein B 5 FT #SUB 90 85 VAL B 89 89 GLN A Protein B 5 FT #SUB 91 86 ARG B 87 87 VAL A Protein A 4 FT #SUB 91 86 ARG B 88 88 ASP A Protein A 4 FT #SUB 92 87 PHE B 86 86 GLN A Protein S 5 FT #SUB 92 87 PHE B 87 87 VAL A Protein A 7 FT #SUB 92 87 PHE B 88 88 ASP A Protein S 1 FT #SUB 139 134 ARG B 88 88 ASP A Protein S 6 FT #SUB 139 134 ARG B 90 90 VAL A Protein S 1 FT #HET 16 11 VAL B 3 201 GOL B S 3 FT #HET 65 60 MET B 1 201 FSE A S 4 FT #HET 82 77 PRO B 2 202 GOL A B 1 FT #HET 112 107 ARG B 3 201 GOL B S 1 FT #HET 113 108 VAL B 3 201 GOL B B 1 FT #HET 114 109 LYS B 3 201 GOL B A 14 CC SEQUENCE 147 AA (ATOM); CC GPLGSMALRE FSSVKVGDQL PEKTYPLTRQ DLVNYAGVSG DLNPIHWDDE IAKVVGLDTA CC IAHGMLTMGI GGGYVTSWVG DPGAVTEYNV RFTAVVPVPN DGKGAELVFN GRVKSVDPES CC KSVTIALTAT TGGKKIFGRA IASAKLA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GPLGSMALREFSSVKVGDQLPEKTYPLTRQDLVNYAGVSGDLNPIHWDDE CC ATOM GPLGSMALREFSSVKVGDQLPEKTYPLTRQDLVNYAGVSGDLNPIHWDDE CC ************************************************** CC SEQRES IAKVVGLDTAIAHGMLTMGIGGGYVTSWVGDPGAVTEYNVRFTAVVPVPN CC ATOM IAKVVGLDTAIAHGMLTMGIGGGYVTSWVGDPGAVTEYNVRFTAVVPVPN CC ************************************************** CC SEQRES DGKGAELVFNGRVKSVDPESKSVTIALTATTGGKKIFGRAIASAKLA CC ATOM DGKGAELVFNGRVKSVDPESKSVTIALTATTGGKKIFGRAIASAKLA CC *********************************************** SQ SEQUENCE 147 AA; MW; CN; GPLGSMALRE FSSVKVGDQL PEKTYPLTRQ DLVNYAGVSG DLNPIHWDDE IAKVVGLDTA IAHGMLTMGI GGGYVTSWVG DPGAVTEYNV RFTAVVPVPN DGKGAELVFN GRVKSVDPES KSVTIALTAT TGGKKIFGRA IASAKLA //