Iron in PDB 7rh7: Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound

All present enzymatic activity of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound:
1.15.1.1; 7.1.1.8; 7.1.1.9;

The structure of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound also contains other interesting chemical elements:

Fluorine	(F)	6 atoms
Chlorine	(Cl)	2 atoms
Copper	(Cu)	6 atoms

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 16;

Binding sites:

The binding sites of Iron atom in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound (pdb code 7rh7). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 16 binding sites of Iron where determined in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound, PDB code: 7rh7:
Jump to Iron binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Iron binding site 1 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ R:Fe602 b:40.3 occ:1.00 FE R:HEA602 0.0 40.3 1.0 ND R:HEA602 2.0 40.3 1.0 NB R:HEA602 2.0 40.3 1.0 NC R:HEA602 2.0 40.3 1.0 NA R:HEA602 2.0 40.3 1.0 NE2 R:HIS399 2.1 37.6 1.0 NE2 R:HIS86 2.5 35.8 1.0 CE1 R:HIS399 3.0 37.6 1.0 C1B R:HEA602 3.0 40.3 1.0 C4D R:HEA602 3.0 40.3 1.0 C1A R:HEA602 3.0 40.3 1.0 C1C R:HEA602 3.0 40.3 1.0 C4B R:HEA602 3.0 40.3 1.0 C1D R:HEA602 3.0 40.3 1.0 C4C R:HEA602 3.0 40.3 1.0 C4A R:HEA602 3.1 40.3 1.0 HE1 R:HIS399 3.1 37.6 1.0 CD2 R:HIS86 3.1 35.8 1.0 HD2 R:HIS86 3.1 35.8 1.0 CD2 R:HIS399 3.2 37.6 1.0 CHA R:HEA602 3.4 40.3 1.0 CHC R:HEA602 3.4 40.3 1.0 HD2 R:HIS399 3.4 37.6 1.0 CHB R:HEA602 3.4 40.3 1.0 CHD R:HEA602 3.4 40.3 1.0 CE1 R:HIS86 3.5 35.8 1.0 HZ R:PHE446 3.7 38.2 1.0 HE1 R:HIS86 3.9 35.8 1.0 HB2 R:ALA59 3.9 37.8 1.0 ND1 R:HIS399 4.1 37.6 1.0 CG R:HIS399 4.2 37.6 1.0 C2B R:HEA602 4.3 40.3 1.0 CG R:HIS86 4.3 35.8 1.0 C3B R:HEA602 4.3 40.3 1.0 C2D R:HEA602 4.3 40.3 1.0 C2C R:HEA602 4.3 40.3 1.0 HE2 R:MET62 4.3 39.6 1.0 C3D R:HEA602 4.3 40.3 1.0 C2A R:HEA602 4.3 40.3 1.0 C3C R:HEA602 4.3 40.3 1.0 C3A R:HEA602 4.3 40.3 1.0 HE1 R:PHE398 4.4 38.5 1.0 ND1 R:HIS86 4.4 35.8 1.0 HHA R:HEA602 4.4 40.3 1.0 HHC R:HEA602 4.5 40.3 1.0 HHD R:HEA602 4.5 40.3 1.0 HHB R:HEA602 4.5 40.3 1.0 CZ R:PHE446 4.5 38.2 1.0 HE1 R:PHE446 4.8 38.2 1.0 CB R:ALA59 4.8 37.8 1.0 HG3 R:MET90 4.8 35.5 1.0 HD1 R:HIS399 4.9 37.6 1.0 HB1 R:ALA59 5.0 37.8 1.0

Iron binding site 2 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ R:Fe603 b:44.0 occ:1.00 FE R:HEA603 0.0 44.0 1.0 NA R:HEA603 2.0 44.0 1.0 NC R:HEA603 2.0 44.0 1.0 NB R:HEA603 2.0 44.0 1.0 ND R:HEA603 2.0 44.0 1.0 NE2 R:HIS397 2.7 39.7 1.0 C1A R:HEA603 3.0 44.0 1.0 C4C R:HEA603 3.0 44.0 1.0 C4A R:HEA603 3.0 44.0 1.0 C1C R:HEA603 3.0 44.0 1.0 C1D R:HEA603 3.0 44.0 1.0 C4B R:HEA603 3.0 44.0 1.0 C1B R:HEA603 3.0 44.0 1.0 C4D R:HEA603 3.0 44.0 1.0 CHC R:HEA603 3.4 44.0 1.0 CHA R:HEA603 3.4 44.0 1.0 CHD R:HEA603 3.4 44.0 1.0 CHB R:HEA603 3.4 44.0 1.0 CE1 R:HIS397 3.5 39.7 1.0 HE1 R:HIS397 3.6 39.7 1.0 CD2 R:HIS397 3.7 39.7 1.0 HE1 R:HIS313 3.8 41.8 1.0 HE1 R:HIS314 3.8 40.4 1.0 HD2 R:HIS397 3.9 39.7 1.0 CU R:CU601 4.1 69.2 1.0 C3A R:HEA603 4.3 44.0 1.0 C3C R:HEA603 4.3 44.0 1.0 C2D R:HEA603 4.3 44.0 1.0 C2B R:HEA603 4.3 44.0 1.0 C3B R:HEA603 4.3 44.0 1.0 C2C R:HEA603 4.3 44.0 1.0 C2A R:HEA603 4.3 44.0 1.0 HE1 R:HIS264 4.3 39.4 1.0 C3D R:HEA603 4.3 44.0 1.0 HG22 R:VAL267 4.4 38.2 1.0 HG22 R:VAL401 4.4 38.7 1.0 HHC R:HEA603 4.5 44.0 1.0 HHD R:HEA603 4.5 44.0 1.0 HHB R:HEA603 4.5 44.0 1.0 HHA R:HEA603 4.5 44.0 1.0 CE1 R:HIS314 4.6 40.4 1.0 CE1 R:HIS313 4.6 41.8 1.0 HB3 R:PHE398 4.7 38.5 1.0 ND1 R:HIS397 4.7 39.7 1.0 CG R:HIS397 4.9 39.7 1.0

Iron binding site 3 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ O:Fe301 b:53.9 occ:1.00 FE O:HEC301 0.0 53.9 1.0 NC O:HEC301 2.0 53.9 1.0 NA O:HEC301 2.1 53.9 1.0 NB O:HEC301 2.1 53.9 1.0 ND O:HEC301 2.1 53.9 1.0 NE2 O:HIS91 2.1 55.0 1.0 SD O:MET122 2.9 52.2 1.0 CD2 O:HIS91 3.0 55.0 1.0 C1A O:HEC301 3.0 53.9 1.0 C4A O:HEC301 3.1 53.9 1.0 C1D O:HEC301 3.1 53.9 1.0 C4C O:HEC301 3.1 53.9 1.0 C1C O:HEC301 3.1 53.9 1.0 C4D O:HEC301 3.1 53.9 1.0 C1B O:HEC301 3.1 53.9 1.0 C4B O:HEC301 3.1 53.9 1.0 HD2 O:HIS91 3.1 55.0 1.0 CE1 O:HIS91 3.1 55.0 1.0 HE1 O:HIS91 3.4 55.0 1.0 CHA O:HEC301 3.4 53.9 1.0 CHD O:HEC301 3.4 53.9 1.0 CHB O:HEC301 3.4 53.9 1.0 CHC O:HEC301 3.4 53.9 1.0 HB3 O:MET122 3.7 52.2 1.0 HD22 O:LEU105 3.8 57.4 1.0 CG O:HIS91 4.1 55.0 1.0 ND1 O:HIS91 4.1 55.0 1.0 CG O:MET122 4.2 52.2 1.0 HE1 O:MET122 4.2 52.2 1.0 C2A O:HEC301 4.2 53.9 1.0 C3A O:HEC301 4.2 53.9 1.0 CE O:MET122 4.2 52.2 1.0 HA O:MET122 4.3 52.2 1.0 C2C O:HEC301 4.3 53.9 1.0 HG3 O:MET122 4.3 52.2 1.0 C3C O:HEC301 4.3 53.9 1.0 HD11 O:LEU105 4.3 57.4 1.0 C2D O:HEC301 4.3 53.9 1.0 CB O:MET122 4.3 52.2 1.0 C3D O:HEC301 4.3 53.9 1.0 C2B O:HEC301 4.3 53.9 1.0 C3B O:HEC301 4.3 53.9 1.0 HHA O:HEC301 4.4 53.9 1.0 HHD O:HEC301 4.4 53.9 1.0 HHB O:HEC301 4.4 53.9 1.0 HD2 O:PRO103 4.4 54.1 1.0 HHC O:HEC301 4.4 53.9 1.0 O O:MET122 4.5 52.2 1.0 HE3 O:MET122 4.6 52.2 1.0 CD2 O:LEU105 4.7 57.4 1.0 CA O:MET122 4.8 52.2 1.0 HD1 O:HIS91 4.9 55.0 1.0 HB2 O:CYS87 4.9 54.0 1.0 HD21 O:LEU105 5.0 57.4 1.0 HE2 O:MET122 5.0 52.2 1.0 HG2 O:MET122 5.0 52.2 1.0

Iron binding site 4 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ O:Fe302 b:46.1 occ:1.00 FE O:HEC302 0.0 46.1 1.0 NA O:HEC302 2.1 46.1 1.0 ND O:HEC302 2.1 46.1 1.0 NC O:HEC302 2.1 46.1 1.0 NB O:HEC302 2.1 46.1 1.0 NE2 O:HIS192 2.2 43.8 1.0 HE3 O:MET229 2.7 47.4 1.0 HD2 O:HIS192 2.8 43.8 1.0 CD2 O:HIS192 2.8 43.8 1.0 HE1 O:MET229 2.8 47.4 1.0 CE O:MET229 3.0 47.4 1.0 C4B O:HEC302 3.0 46.1 1.0 C1C O:HEC302 3.1 46.1 1.0 C4D O:HEC302 3.1 46.1 1.0 C1D O:HEC302 3.1 46.1 1.0 C1B O:HEC302 3.1 46.1 1.0 C1A O:HEC302 3.1 46.1 1.0 C4A O:HEC302 3.1 46.1 1.0 C4C O:HEC302 3.1 46.1 1.0 SD O:MET229 3.1 47.4 1.0 HG3 O:MET229 3.2 47.4 1.0 CE1 O:HIS192 3.3 43.8 1.0 CHC O:HEC302 3.4 46.1 1.0 CHA O:HEC302 3.4 46.1 1.0 CHD O:HEC302 3.4 46.1 1.0 CHB O:HEC302 3.4 46.1 1.0 HE1 O:HIS192 3.7 43.8 1.0 CG O:MET229 3.7 47.4 1.0 HE2 O:MET229 3.9 47.4 1.0 CG O:HIS192 4.0 43.8 1.0 C3B O:HEC302 4.2 46.1 1.0 C2B O:HEC302 4.3 46.1 1.0 ND1 O:HIS192 4.3 43.8 1.0 C2C O:HEC302 4.3 46.1 1.0 HD22 O:LEU210 4.3 46.3 1.0 C2A O:HEC302 4.3 46.1 1.0 C3A O:HEC302 4.3 46.1 1.0 C3D O:HEC302 4.3 46.1 1.0 C2D O:HEC302 4.3 46.1 1.0 C3C O:HEC302 4.3 46.1 1.0 HG2 O:MET229 4.4 47.4 1.0 HHD O:HEC302 4.4 46.1 1.0 HHB O:HEC302 4.4 46.1 1.0 HHA O:HEC302 4.4 46.1 1.0 HHC O:HEC302 4.4 46.1 1.0 HB2 O:MET229 4.4 47.4 1.0 CB O:MET229 4.7 47.4 1.0 HB3 O:ALA207 4.8 42.6 1.0 SG O:CYS188 5.0 45.5 1.0

Iron binding site 5 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 5 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ E:Fe603 b:31.4 occ:1.00 FE E:HEM603 0.0 31.4 1.0 NB E:HEM603 2.0 31.4 1.0 NC E:HEM603 2.0 31.4 1.0 NA E:HEM603 2.0 31.4 1.0 ND E:HEM603 2.0 31.4 1.0 NE2 E:HIS226 2.1 35.1 1.0 HD2 E:HIS123 2.4 33.2 1.0 NE2 E:HIS123 2.7 33.2 1.0 CD2 E:HIS123 2.8 33.2 1.0 CE1 E:HIS226 2.9 35.1 1.0 CD2 E:HIS226 2.9 35.1 1.0 C4B E:HEM603 3.0 31.4 1.0 C1B E:HEM603 3.0 31.4 1.0 C1C E:HEM603 3.0 31.4 1.0 C4D E:HEM603 3.0 31.4 1.0 C4A E:HEM603 3.0 31.4 1.0 C1A E:HEM603 3.1 31.4 1.0 C4C E:HEM603 3.1 31.4 1.0 C1D E:HEM603 3.1 31.4 1.0 HE1 E:HIS226 3.1 35.1 1.0 HD2 E:HIS226 3.2 35.1 1.0 CHC E:HEM603 3.4 31.4 1.0 CHB E:HEM603 3.4 31.4 1.0 CHA E:HEM603 3.4 31.4 1.0 CHD E:HEM603 3.4 31.4 1.0 ND1 E:HIS226 3.9 35.1 1.0 CG E:HIS226 3.9 35.1 1.0 CE1 E:HIS123 4.0 33.2 1.0 CG E:HIS123 4.2 33.2 1.0 C3B E:HEM603 4.2 31.4 1.0 C2B E:HEM603 4.2 31.4 1.0 C2C E:HEM603 4.2 31.4 1.0 C3D E:HEM603 4.2 31.4 1.0 C3A E:HEM603 4.2 31.4 1.0 C2A E:HEM603 4.3 31.4 1.0 C3C E:HEM603 4.3 31.4 1.0 C2D E:HEM603 4.3 31.4 1.0 HHB E:HEM603 4.3 31.4 1.0 HHD E:HEM603 4.3 31.4 1.0 HHC E:HEM603 4.4 31.4 1.0 HHA E:HEM603 4.4 31.4 1.0 HE1 E:HIS123 4.5 33.2 1.0 HA3 E:GLY43 4.6 32.7 1.0 HD1 E:HIS226 4.6 35.1 1.0 ND1 E:HIS123 4.7 33.2 1.0 HA3 E:GLY144 4.8 32.9 1.0 HD13 E:ILE127 4.8 33.7 1.0 HG21 E:ILE127 4.8 33.7 1.0 HD12 E:LEU147 4.9 33.9 1.0

Iron binding site 6 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 6 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ E:Fe604 b:29.9 occ:1.00 FE E:HEM604 0.0 29.9 1.0 NE2 E:HIS211 1.9 32.4 1.0 NC E:HEM604 2.0 29.9 1.0 NA E:HEM604 2.0 29.9 1.0 NB E:HEM604 2.1 29.9 1.0 ND E:HEM604 2.1 29.9 1.0 NE2 E:HIS109 2.5 32.2 1.0 CE1 E:HIS211 2.7 32.4 1.0 HE1 E:HIS211 2.8 32.4 1.0 CD2 E:HIS211 3.0 32.4 1.0 C4A E:HEM604 3.0 29.9 1.0 C4C E:HEM604 3.0 29.9 1.0 C1B E:HEM604 3.1 29.9 1.0 C1C E:HEM604 3.1 29.9 1.0 C1A E:HEM604 3.1 29.9 1.0 C1D E:HEM604 3.1 29.9 1.0 C4D E:HEM604 3.1 29.9 1.0 C4B E:HEM604 3.1 29.9 1.0 HD2 E:HIS211 3.3 32.4 1.0 CHB E:HEM604 3.4 29.9 1.0 CE1 E:HIS109 3.4 32.2 1.0 CHD E:HEM604 3.4 29.9 1.0 CHA E:HEM604 3.4 29.9 1.0 CHC E:HEM604 3.4 29.9 1.0 HE1 E:HIS109 3.5 32.2 1.0 CD2 E:HIS109 3.5 32.2 1.0 HD2 E:HIS109 3.7 32.2 1.0 ND1 E:HIS211 3.9 32.4 1.0 HA3 E:GLY158 4.0 31.5 1.0 CG E:HIS211 4.0 32.4 1.0 C3A E:HEM604 4.3 29.9 1.0 C3C E:HEM604 4.3 29.9 1.0 C2A E:HEM604 4.3 29.9 1.0 C2C E:HEM604 4.3 29.9 1.0 C2B E:HEM604 4.3 29.9 1.0 C2D E:HEM604 4.3 29.9 1.0 C3D E:HEM604 4.3 29.9 1.0 HD22 E:LEU53 4.3 32.9 1.0 C3B E:HEM604 4.3 29.9 1.0 HA2 E:GLY158 4.3 31.5 1.0 HHB E:HEM604 4.4 29.9 1.0 HHD E:HEM604 4.4 29.9 1.0 HHC E:HEM604 4.4 29.9 1.0 HHA E:HEM604 4.4 29.9 1.0 ND1 E:HIS109 4.6 32.2 1.0 HD1 E:HIS211 4.6 32.4 1.0 CA E:GLY158 4.7 31.5 1.0 CG E:HIS109 4.7 32.2 1.0 O E:HIS211 4.8 32.4 1.0 HA2 E:GLY57 4.9 32.1 1.0 HD12 E:LEU60 4.9 32.6 1.0 HA3 E:GLY57 5.0 32.1 1.0

Iron binding site 7 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 7 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ L:Fe601 b:43.2 occ:1.00 FE L:HEA601 0.0 43.2 1.0 NA L:HEA601 2.0 43.2 1.0 NC L:HEA601 2.0 43.2 1.0 ND L:HEA601 2.0 43.2 1.0 NB L:HEA601 2.0 43.2 1.0 NE2 L:HIS397 2.7 38.9 1.0 C1A L:HEA601 3.0 43.2 1.0 C1C L:HEA601 3.0 43.2 1.0 C4A L:HEA601 3.0 43.2 1.0 C4B L:HEA601 3.0 43.2 1.0 C1D L:HEA601 3.0 43.2 1.0 C4C L:HEA601 3.0 43.2 1.0 C4D L:HEA601 3.0 43.2 1.0 C1B L:HEA601 3.0 43.2 1.0 CHC L:HEA601 3.4 43.2 1.0 CHA L:HEA601 3.4 43.2 1.0 CHB L:HEA601 3.4 43.2 1.0 CHD L:HEA601 3.4 43.2 1.0 HE1 L:HIS397 3.5 38.9 1.0 CE1 L:HIS397 3.5 38.9 1.0 CD2 L:HIS397 3.8 38.9 1.0 HE1 L:HIS313 3.9 41.0 1.0 HD2 L:HIS397 4.0 38.9 1.0 HE1 L:HIS314 4.1 40.2 1.0 HG21 L:VAL267 4.2 38.1 1.0 C3A L:HEA601 4.3 43.2 1.0 C2D L:HEA601 4.3 43.2 1.0 C3C L:HEA601 4.3 43.2 1.0 C2C L:HEA601 4.3 43.2 1.0 C3B L:HEA601 4.3 43.2 1.0 C2A L:HEA601 4.3 43.2 1.0 C2B L:HEA601 4.3 43.2 1.0 C3D L:HEA601 4.3 43.2 1.0 HHC L:HEA601 4.5 43.2 1.0 HHA L:HEA601 4.5 43.2 1.0 HHB L:HEA601 4.5 43.2 1.0 HHD L:HEA601 4.5 43.2 1.0 HB3 L:PHE398 4.6 37.6 1.0 CE1 L:HIS313 4.6 41.0 1.0 HE1 L:HIS264 4.6 39.6 1.0 ND1 L:HIS397 4.7 38.9 1.0 HG23 L:VAL401 4.8 38.3 1.0 CE1 L:HIS314 4.8 40.2 1.0 CG L:HIS397 4.9 38.9 1.0 CU L:CU602 5.0 67.3 1.0 HA L:PHE398 5.0 37.6 1.0

Iron binding site 8 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 8 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ L:Fe603 b:38.6 occ:1.00 FE L:HEA603 0.0 38.6 1.0 NE2 L:HIS399 1.9 37.0 1.0 NA L:HEA603 2.0 38.6 1.0 NC L:HEA603 2.0 38.6 1.0 ND L:HEA603 2.0 38.6 1.0 NB L:HEA603 2.0 38.6 1.0 NE2 L:HIS86 2.6 35.5 1.0 CE1 L:HIS399 2.7 37.0 1.0 HE1 L:HIS399 2.8 37.0 1.0 HD2 L:HIS86 3.0 35.5 1.0 C1A L:HEA603 3.0 38.6 1.0 C1B L:HEA603 3.0 38.6 1.0 C4C L:HEA603 3.0 38.6 1.0 C1D L:HEA603 3.0 38.6 1.0 C4D L:HEA603 3.0 38.6 1.0 C1C L:HEA603 3.0 38.6 1.0 C4A L:HEA603 3.0 38.6 1.0 C4B L:HEA603 3.0 38.6 1.0 CD2 L:HIS399 3.0 37.0 1.0 CD2 L:HIS86 3.1 35.5 1.0 HD2 L:HIS399 3.3 37.0 1.0 CHC L:HEA603 3.4 38.6 1.0 CHD L:HEA603 3.4 38.6 1.0 CHA L:HEA603 3.4 38.6 1.0 CHB L:HEA603 3.4 38.6 1.0 HZ L:PHE446 3.8 37.3 1.0 CE1 L:HIS86 3.8 35.5 1.0 ND1 L:HIS399 3.9 37.0 1.0 CG L:HIS399 4.0 37.0 1.0 HE1 L:HIS86 4.1 35.5 1.0 HE1 L:PHE398 4.2 37.6 1.0 C3A L:HEA603 4.3 38.6 1.0 C2B L:HEA603 4.3 38.6 1.0 C3C L:HEA603 4.3 38.6 1.0 C2D L:HEA603 4.3 38.6 1.0 C2C L:HEA603 4.3 38.6 1.0 C2A L:HEA603 4.3 38.6 1.0 C3B L:HEA603 4.3 38.6 1.0 C3D L:HEA603 4.3 38.6 1.0 CG L:HIS86 4.4 35.5 1.0 HHC L:HEA603 4.5 38.6 1.0 HHD L:HEA603 4.5 38.6 1.0 HHA L:HEA603 4.5 38.6 1.0 HHB L:HEA603 4.5 38.6 1.0 CZ L:PHE446 4.6 37.3 1.0 HD1 L:HIS399 4.6 37.0 1.0 HE1 L:MET62 4.6 39.4 1.0 ND1 L:HIS86 4.7 35.5 1.0 HB2 L:ALA59 4.8 37.4 1.0 HE1 L:PHE446 4.8 37.3 1.0 HB3 L:ALA59 4.8 37.4 1.0 HG3 L:MET90 4.9 35.4 1.0 HG23 L:ILE395 5.0 37.7 1.0

Iron binding site 9 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 9 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ I:Fe301 b:54.1 occ:1.00 FE I:HEC301 0.0 54.1 1.0 NE2 I:HIS91 1.9 54.6 1.0 NC I:HEC301 2.1 54.1 1.0 NB I:HEC301 2.1 54.1 1.0 NA I:HEC301 2.1 54.1 1.0 ND I:HEC301 2.1 54.1 1.0 HE1 I:MET122 2.2 52.3 1.0 HE3 I:MET122 2.5 52.3 1.0 CE I:MET122 2.7 52.3 1.0 CD2 I:HIS91 2.8 54.6 1.0 CE1 I:HIS91 2.9 54.6 1.0 HD2 I:HIS91 3.0 54.6 1.0 C4A I:HEC301 3.1 54.1 1.0 C1A I:HEC301 3.1 54.1 1.0 C1D I:HEC301 3.1 54.1 1.0 C4C I:HEC301 3.1 54.1 1.0 C1B I:HEC301 3.1 54.1 1.0 C4D I:HEC301 3.1 54.1 1.0 C1C I:HEC301 3.1 54.1 1.0 C4B I:HEC301 3.1 54.1 1.0 HE1 I:HIS91 3.1 54.6 1.0 HE2 I:MET122 3.4 52.3 1.0 CHD I:HEC301 3.4 54.1 1.0 CHB I:HEC301 3.4 54.1 1.0 CHA I:HEC301 3.4 54.1 1.0 HD12 I:LEU105 3.5 57.5 1.0 CHC I:HEC301 3.5 54.1 1.0 HG3 I:MET122 3.5 52.3 1.0 HG2 I:MET122 3.8 52.3 1.0 CG I:MET122 3.9 52.3 1.0 CG I:HIS91 3.9 54.6 1.0 ND1 I:HIS91 3.9 54.6 1.0 SD I:MET122 4.0 52.3 1.0 C3A I:HEC301 4.2 54.1 1.0 C2A I:HEC301 4.2 54.1 1.0 C2D I:HEC301 4.3 54.1 1.0 C3D I:HEC301 4.3 54.1 1.0 C2C I:HEC301 4.3 54.1 1.0 C2B I:HEC301 4.3 54.1 1.0 C3C I:HEC301 4.3 54.1 1.0 HHD I:HEC301 4.3 54.1 1.0 C3B I:HEC301 4.3 54.1 1.0 HHA I:HEC301 4.4 54.1 1.0 HHB I:HEC301 4.4 54.1 1.0 CD1 I:LEU105 4.4 57.5 1.0 HHC I:HEC301 4.5 54.1 1.0 HD2 I:PRO103 4.5 54.3 1.0 HD21 I:LEU105 4.6 57.5 1.0 HB2 I:CYS87 4.7 53.0 1.0 HD11 I:LEU105 4.7 57.5 1.0 HD1 I:HIS91 4.7 54.6 1.0 HD13 I:LEU105 4.8 57.5 1.0 O I:MET122 4.9 52.3 1.0 HB2 I:CYS90 5.0 52.2 1.0

Iron binding site 10 out of 16 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 10 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range: probe atom residue distance (Å) B Occ I:Fe302 b:45.7 occ:1.00 FE I:HEC302 0.0 45.7 1.0 NC I:HEC302 2.1 45.7 1.0 NB I:HEC302 2.1 45.7 1.0 ND I:HEC302 2.1 45.7 1.0 NA I:HEC302 2.1 45.7 1.0 NE2 I:HIS192 2.1 43.0 1.0 HE1 I:MET229 2.2 47.1 1.0 HD2 I:HIS192 2.7 43.0 1.0 CD2 I:HIS192 2.7 43.0 1.0 CE I:MET229 2.9 47.1 1.0 C1D I:HEC302 3.0 45.7 1.0 C1C I:HEC302 3.1 45.7 1.0 C4D I:HEC302 3.1 45.7 1.0 HE2 I:MET229 3.1 47.1 1.0 C4B I:HEC302 3.1 45.7 1.0 C1B I:HEC302 3.1 45.7 1.0 C4A I:HEC302 3.1 45.7 1.0 C1A I:HEC302 3.1 45.7 1.0 C4C I:HEC302 3.1 45.7 1.0 CE1 I:HIS192 3.3 43.0 1.0 CHD I:HEC302 3.4 45.7 1.0 CHB I:HEC302 3.4 45.7 1.0 CHC I:HEC302 3.4 45.7 1.0 SD I:MET229 3.4 47.1 1.0 CHA I:HEC302 3.4 45.7 1.0 HE1 I:HIS192 3.7 43.0 1.0 HE3 I:MET229 3.8 47.1 1.0 CG I:HIS192 4.0 43.0 1.0 ND1 I:HIS192 4.2 43.0 1.0 C2D I:HEC302 4.3 45.7 1.0 C2C I:HEC302 4.3 45.7 1.0 C3D I:HEC302 4.3 45.7 1.0 HB3 I:ALA207 4.3 42.0 1.0 C2B I:HEC302 4.3 45.7 1.0 C3B I:HEC302 4.3 45.7 1.0 C3A I:HEC302 4.3 45.7 1.0 HHD I:HEC302 4.3 45.7 1.0 C2A I:HEC302 4.3 45.7 1.0 C3C I:HEC302 4.3 45.7 1.0 HHB I:HEC302 4.4 45.7 1.0 HHC I:HEC302 4.4 45.7 1.0 HHA I:HEC302 4.4 45.7 1.0 HD11 I:LEU210 4.5 46.5 1.0 HB3 I:CYS191 4.8 41.6 1.0 SG I:CYS188 4.8 44.3 1.0

D.J.Yanofsky, J.M.Di Trani, S.Krol, R.Abdelaziz, S.A.Bueler, P.Imming, P.Brzezinski, J.L.Rubinstein. Structure of Mycobacterial CIII2CIV2 Respiratory Supercomplex Bound to the Tuberculosis Drug Candidate Telacebec (Q203) To Be Published.