3LOU

crystal structure of formyltetrahydrofolate deformylase (yp_105254.1) from burkholderia mallei atcc 23344 at 1.90 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 150
  • Norm. En. per Res.: -3.649
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-70.9779	-89.9019	-386.474	-547.3538	150	14	6	15840	13	63	53
A-C	0.0	0.0	-36.0276	-36.0276	65	0	1	1890	0	31	34
A-D	-15.2703	27.5658	-80.3201	-68.0246	77	3	10	4512	0	15	15
B-C	0.0	27.4822	-64.7363	-37.2541	78	2	10	4034	0	16	16
B-D	0.0	4.8612	-42.5835	-37.7223	65	0	1	2234	0	31	39
C-D	-78.6061	-70.0932	-377.655	-526.3543	145	21	6	15717	12	61	53

Interface residues

• A-B: ALA215A, ALA215B, ALA217A, ALA217B, ALA225A, ALA225B, ALA227A, ALA227B, ARG218A, ARG218B, ARG246A, ARG246B, ARG252A, ARG252B, ARG270A, ARG270B, ARG279A, ARG279B, ARG286A, ARG286B, ASN283A, ASN283B, ASP233A, ASP233B, ASP235A, ASP235B, ASP248A, ASP248B, ASP285A, ASP285B, ASP44A, ASP44B, ASP45A, ASP45B, ASP46A, ASP46B, GLN214A, GLN214B, GLN242A, GLN242B, GLN255A, GLN291A, GLN291B, GLU236A, GLU236B, GLU241A, GLU241B, GLU245A, GLU245B, GLU254A, GLU254B, GLY205A, GLY205B, GLY219A, GLY219B, GLY224A, GLY224B, GLY237A, GLY237B, GLY284A, GLY284B, HIS199A, HIS199B, HIS200A, HIS200B, HIS213A, HIS213B, HIS216A, HIS216B, HIS228A, HIS228B, HIS249A, HIS249B, ILE223A, ILE223B, ILE239A, ILE239B, ILE240A, ILE240B, ILE266A, ILE266B, LEU203A, LEU203B, LEU222A, LEU222B, LEU234A, LEU234B, LEU256A, LEU256B, LEU47A, LEU47B, LYS207B, LYS221A, LYS221B, PHE202A, PHE202B, PHE206A, PHE206B, PHE229A, PHE229B, PHE281A, PHE281B, PHE290A, PHE290B, PHE43A, PHE43B, PHE52A, PHE52B, PRO204A, PRO204B, PRO238A, PRO238B, PRO253A, PRO253B, SER201A, SER201B, SER250A, SER250B, SER48A, SER48B, THR226A, THR226B, THR231A, THR231B, THR267A, THR267B, THR287A, THR287B, THR41A, THR41B, TYR251A, TYR251B, VAL220A, VAL220B, VAL243A, VAL243B, VAL244A, VAL244B, VAL247A, VAL247B, VAL263A, VAL263B, VAL280A, VAL280B, VAL288A, VAL288B, VAL289A, VAL289B, VAL42A, VAL42B
• A-C: ALA109A, ALA109C, ALA258A, ALA258C, ARG114A, ARG114C, ARG246A, ARG252A, ARG252C, ARG270A, ARG270C, ASP110A, ASP110C, ASP248A, ASP248C, ASP262A, ASP262C, ASP38A, CYS107A, CYS107C, CYS265A, CYS265C, GLN140A, GLN140C, GLN255A, GLN255C, GLN291A, GLN291C, GLN9A, GLN9C, GLU105A, GLU105C, GLU119A, GLU119C, GLU245A, GLU245C, GLU277C, GLU39A, GLU39C, HIS106A, HIS106C, HIS141A, HIS141C, HIS249A, ILE266A, LEU108A, LEU108C, LEU111A, LEU111C, LEU112A, LEU112C, LEU137A, LEU137C, LYS116A, LYS116C, LYS273A, LYS273C, PHE113A, PHE113C, PRO7A, PRO7C, SER250A, SER250C, TYR251A, TYR251C
• A-D: ALA19A, ALA19D, ALA20A, ALA20D, ALA24A, ALA24D, ALA25A, ALA25D, ALA49A, ALA49D, ARG32D, ARG34A, ARG34D, ARG50A, ARG50D, ARG54A, ASP31A, ASP31D, ASP38A, ASP38D, ASP44A, ASP44D, ASP45A, ASP45D, ASP46A, ASP46D, CYS35A, CYS35D, CYS55A, GLN22A, GLN22D, GLN291A, GLN291D, GLN9A, GLU39A, GLU39D, GLY21A, GLY21D, GLY28A, GLY28D, HIS58A, HIS58D, LEU29A, LEU29D, LEU30A, LEU30D, LEU40A, LEU40D, LEU47A, LEU47D, PHE43A, PHE43D, PHE51A, PHE51D, PHE82A, PHE82D, PRO7A, SER18A, SER18D, THR41A, THR41D, THR60A, THR60D, TYR36A, TYR36D, VAL23A, VAL23D, VAL26A, VAL26D, VAL27A, VAL27D, VAL37A, VAL37D, VAL42A, VAL42D, VAL53A, VAL53D
• B-C: ALA19B, ALA19C, ALA20B, ALA20C, ALA24B, ALA24C, ALA25B, ALA25C, ALA49B, ALA49C, ARG32B, ARG34B, ARG34C, ARG50B, ARG81C, ASP31B, ASP31C, ASP38B, ASP38C, ASP44B, ASP44C, ASP45B, ASP45C, ASP46B, ASP46C, CYS35B, CYS35C, CYS55B, CYS55C, GLN22B, GLN22C, GLN291B, GLN291C, GLN9C, GLU39B, GLU39C, GLY21B, GLY21C, GLY28B, GLY28C, HIS58B, HIS58C, LEU29B, LEU29C, LEU30B, LEU30C, LEU40B, LEU40C, LEU47B, LEU47C, PHE290B, PHE43B, PHE43C, PHE51B, PHE51C, PHE82B, PHE82C, PRO17B, PRO7C, SER18B, SER18C, THR41B, THR41C, THR60C, TYR36B, TYR36C, VAL23B, VAL23C, VAL26B, VAL26C, VAL27B, VAL27C, VAL37B, VAL37C, VAL42B, VAL42C, VAL53B, VAL53C
• B-D: ALA109B, ALA109D, ALA258B, ALA258D, ARG114B, ARG114D, ARG246B, ARG252B, ARG252D, ARG270B, ARG270D, ASP110B, ASP110D, ASP248B, ASP248D, ASP262B, ASP262D, ASP38B, ASP38D, CYS107B, CYS107D, CYS265B, CYS265D, GLN140B, GLN140D, GLN255B, GLN255D, GLN291B, GLN291D, GLN9B, GLN9D, GLU105B, GLU105D, GLU119B, GLU119D, GLU245B, GLU245D, GLU39B, GLU39D, HIS106B, HIS106D, HIS141B, HIS141D, ILE266B, LEU108B, LEU108D, LEU111B, LEU111D, LEU112B, LEU112D, LEU137B, LEU137D, LEU40B, LYS116B, LYS116D, LYS273B, LYS273D, PHE113B, PHE113D, SER250B, SER250D, TYR251B, TYR251D, TYR36B, TYR36D
• C-D: ALA215C, ALA215D, ALA217C, ALA217D, ALA225C, ALA225D, ALA227C, ALA227D, ARG218C, ARG218D, ARG246C, ARG246D, ARG252C, ARG252D, ARG270C, ARG270D, ARG279C, ARG279D, ARG286C, ARG286D, ASN283C, ASN283D, ASP233C, ASP233D, ASP235C, ASP235D, ASP248C, ASP248D, ASP285C, ASP285D, ASP44C, ASP44D, ASP45C, ASP45D, ASP46C, ASP46D, GLN214C, GLN214D, GLN242C, GLN242D, GLN291C, GLN291D, GLU236C, GLU236D, GLU241C, GLU241D, GLU245C, GLU245D, GLU254C, GLU254D, GLY205C, GLY205D, GLY219C, GLY219D, GLY224C, GLY224D, GLY237C, GLY237D, GLY284C, GLY284D, HIS199C, HIS199D, HIS200D, HIS213C, HIS213D, HIS216C, HIS216D, HIS228C, HIS228D, HIS249C, HIS249D, ILE223C, ILE223D, ILE239C, ILE239D, ILE240C, ILE240D, LEU203C, LEU203D, LEU222C, LEU222D, LEU234C, LEU234D, LEU256C, LEU256D, LEU47C, LEU47D, LYS207D, LYS221C, LYS221D, PHE202C, PHE202D, PHE206C, PHE206D, PHE229C, PHE229D, PHE281C, PHE281D, PHE290C, PHE290D, PHE43C, PHE43D, PHE52C, PHE52D, PRO204C, PRO204D, PRO238C, PRO238D, PRO253C, PRO253D, SER201C, SER201D, SER250C, SER250D, SER48C, SER48D, THR226C, THR226D, THR231C, THR231D, THR267C, THR267D, THR287C, THR287D, THR41C, THR41D, TYR251C, TYR251D, VAL220C, VAL220D, VAL243C, VAL243D, VAL244C, VAL244D, VAL247C, VAL247D, VAL263C, VAL263D, VAL280D, VAL288C, VAL288D, VAL289C, VAL289D, VAL42C, VAL42D