3OBI

crystal structure of a formyltetrahydrofolate deformylase (np_949368) from rhodopseudomonas palustris cga009 at 1.95 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 87
  • Norm. En. per Res.: -3.7357
• 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	-16.2492	-74.0717	-117.844	-208.1649	91	9	3	4971	9	73	83
A-C	-73.9629	-33.3357	-408.259	-515.5575	148	15	4	17116	1	57	80
A-D	-88.9595	0.0	-236.049	-325.0085	87	15	11	8921	0	10	12
B-C	-70.608	0.0	-229.23	-299.838	90	18	11	8983	0	12	9
B-D	-62.3449	-52.3419	-408.07	-522.7568	148	12	4	17003	2	55	77
C-D	-19.6274	-1.2174	-93.713	-114.5578	76	10	3	4188	6	61	76

Interface residues

• A-B: ALA103A, ALA103B, ALA36A, ALA36B, ARG108A, ARG108B, ARG110A, ARG110B, ARG241A, ARG241B, ARG245A, ARG245B, ARG253A, ARG253B, ARG256A, ARG256B, ARG260A, ARG260B, ARG261A, ARG261B, ARG274A, ARG274B, ARG50A, ARG50B, ARG85B, ASP104A, ASP104B, ASP113A, ASP113B, ASP134A, ASP134B, ASP137B, ASP246A, ASP246B, ASP257A, ASP257B, ASP272B, ASP287A, ASP287B, ASP35A, ASP35B, ASP99A, ASP99B, CYS101A, CYS101B, GLN37A, GLN37B, GLN5A, GLN5B, GLY112A, GLY112B, GLY132A, GLY132B, GLY136A, GLY136B, HIS100A, HIS100B, HIS244A, HIS244B, HIS268A, HIS268B, ILE105A, ILE105B, ILE242A, LEU102A, LEU102B, LEU106A, LEU106B, LEU34A, LEU34B, LYS254A, LYS254B, PHE133A, PHE133B, PHE135B, SER131A, SER131B, SER243A, SER243B, SER264A, SER264B, THR247A, THR247B, THR286A, THR286B, TRP109B, TYR107A, TYR107B, VAL111A, VAL111B, VAL52B
• A-C: ALA210A, ALA210C, ALA220A, ALA220C, ALA222A, ALA222C, ALA228A, ALA228C, ARG213A, ARG213C, ARG241A, ARG241C, ARG245A, ARG245C, ARG261C, ARG265A, ARG265C, ARG274A, ARG274C, ARG280A, ARG280C, ASN278A, ASN278C, ASN40A, ASN40C, ASP212A, ASP212C, ASP230A, ASP230C, ASP236A, ASP236C, ASP238A, ASP238C, ASP246A, ASP246C, ASP287A, ASP41A, ASP41C, GLN209A, GLN209C, GLN237A, GLN237C, GLN37A, GLN37C, GLN38A, GLN38C, GLU231A, GLU231C, GLU240A, GLU240C, GLU43A, GLU43C, GLY200A, GLY200C, GLY214A, GLY214C, GLY219A, GLY219C, GLY232A, GLY232C, HIS194A, HIS194C, HIS195A, HIS195C, HIS208A, HIS208C, HIS223A, HIS223C, HIS244A, HIS244C, ILE218A, ILE218C, ILE234A, ILE234C, ILE235A, ILE235C, ILE242A, ILE242C, ILE258A, ILE258C, ILE276A, ILE276C, LEU198A, LEU198C, LEU217A, LEU217C, LEU229A, LEU229C, LEU251A, LEU251C, LYS202A, LYS202C, LYS216A, LYS216C, LYS281A, LYS281C, PHE197A, PHE197C, PHE201A, PHE201C, PHE211A, PHE211C, PHE285A, PHE285C, PHE48A, PHE48C, PRO199A, PRO199C, PRO233A, PRO233C, PRO248A, PRO248C, SER196A, SER196C, SER243A, SER243C, SER44A, SER44C, THR221A, THR221C, THR226A, THR226C, THR247A, THR247C, THR282A, THR282C, THR286A, THR286C, THR42A, THR42C, TYR224A, TYR224C, TYR269A, TYR269C, TYR39A, TYR39C, VAL215A, VAL215C, VAL239A, VAL239C, VAL262A, VAL262C, VAL275A, VAL275C, VAL283A, VAL283C, VAL284A, VAL284C
• A-D: ALA16A, ALA16D, ALA21A, ALA21D, ALA36A, ALA36D, ALA56A, ALA56D, ALA57A, ALA57D, ARG15A, ARG15D, ARG50A, ARG50D, ASN32A, ASN32D, ASN40A, ASN40D, ASN54A, ASN54D, ASP14A, ASP14D, ASP287A, ASP35A, ASP35D, ASP41A, ASP41D, GLN31A, GLN31D, GLN37A, GLN37D, GLN38A, GLN38D, GLN5A, GLN5D, GLU28A, GLU28D, GLY17A, GLY17D, GLY30A, GLY30D, GLY45A, GLY45D, ILE18A, ILE18D, ILE33A, ILE33D, LEU26A, LEU26D, LEU34A, LEU34D, LYS75D, PHE25A, PHE25D, PHE27A, PHE27D, PHE285A, PHE285D, PHE47A, PHE47D, PHE48A, PHE48D, PHE53A, PHE53D, PHE76A, PHE76D, SER20A, SER20D, SER23A, SER23D, THR24A, THR24D, THR286A, THR286D, THR42A, THR42D, TYR39A, TYR39D, VAL19A, VAL19D, VAL22A, VAL22D, VAL284D, VAL51A, VAL51D, VAL52A, VAL52D
• B-C: ALA16B, ALA16C, ALA21B, ALA21C, ALA36B, ALA36C, ALA56B, ALA56C, ALA57B, ALA57C, ARG15B, ARG15C, ARG245B, ARG245C, ARG274B, ARG50B, ARG50C, ASN32B, ASN32C, ASN40B, ASN40C, ASN54B, ASN54C, ASP14B, ASP14C, ASP287B, ASP35B, ASP35C, ASP41B, ASP41C, GLN31B, GLN31C, GLN37B, GLN37C, GLN38B, GLN38C, GLN5B, GLN5C, GLU28B, GLU28C, GLY17B, GLY17C, GLY30B, GLY30C, GLY45B, GLY45C, ILE18B, ILE18C, ILE33B, ILE33C, LEU26B, LEU26C, LEU34B, LEU34C, LYS75C, PHE25B, PHE25C, PHE27B, PHE27C, PHE285B, PHE285C, PHE47B, PHE47C, PHE48B, PHE48C, PHE53B, PHE53C, PHE76B, PHE76C, SER20B, SER20C, SER23B, SER23C, THR24B, THR24C, THR286B, THR286C, THR42B, THR42C, TYR39B, TYR39C, VAL19B, VAL19C, VAL22B, VAL22C, VAL284C, VAL51B, VAL51C, VAL52B, VAL52C
• B-D: ALA210B, ALA210D, ALA220B, ALA220D, ALA222B, ALA222D, ALA228B, ALA228D, ARG213B, ARG213D, ARG241B, ARG241D, ARG245B, ARG245D, ARG261B, ARG261D, ARG265B, ARG265D, ARG274B, ARG274D, ARG280B, ARG280D, ASN278B, ASN278D, ASN40B, ASN40D, ASP212B, ASP212D, ASP230B, ASP230D, ASP236B, ASP236D, ASP238B, ASP238D, ASP246B, ASP246D, ASP41B, ASP41D, GLN209B, GLN209D, GLN237B, GLN237D, GLN37B, GLN37D, GLN38B, GLN38D, GLU231B, GLU231D, GLU240B, GLU240D, GLU43B, GLU43D, GLY200B, GLY200D, GLY214B, GLY214D, GLY219B, GLY219D, GLY232B, GLY232D, GLY279D, HIS194B, HIS194D, HIS195B, HIS195D, HIS208B, HIS208D, HIS223B, HIS223D, HIS244B, HIS244D, ILE218B, ILE218D, ILE234B, ILE234D, ILE235B, ILE235D, ILE242B, ILE242D, ILE258B, ILE258D, ILE276B, ILE276D, LEU198B, LEU198D, LEU217B, LEU217D, LEU229B, LEU251B, LEU251D, LYS202B, LYS202D, LYS216B, LYS216D, LYS281B, LYS281D, PHE197B, PHE197D, PHE201B, PHE201D, PHE211B, PHE211D, PHE285B, PHE285D, PHE48B, PHE48D, PRO199B, PRO199D, PRO233B, PRO233D, PRO248B, PRO248D, SER196B, SER196D, SER243B, SER243D, SER44B, SER44D, THR221B, THR221D, THR226B, THR226D, THR247B, THR247D, THR282B, THR282D, THR286B, THR286D, THR42B, THR42D, TYR224B, TYR224D, TYR269B, TYR269D, TYR39B, TYR39D, VAL215B, VAL215D, VAL239B, VAL239D, VAL262B, VAL262D, VAL275B, VAL275D, VAL283B, VAL283D, VAL284B, VAL284D
• C-D: ALA103C, ALA103D, ALA36C, ALA36D, ARG108C, ARG108D, ARG110C, ARG110D, ARG245C, ARG245D, ARG253C, ARG253D, ARG256C, ARG256D, ARG260C, ARG260D, ARG261C, ARG261D, ARG274C, ARG274D, ARG50C, ARG50D, ASP104C, ASP104D, ASP113C, ASP113D, ASP134C, ASP134D, ASP137C, ASP257C, ASP257D, ASP35C, ASP35D, ASP99C, ASP99D, CYS101C, CYS101D, GLN37C, GLN37D, GLN5C, GLN5D, GLY112C, GLY112D, GLY132C, GLY132D, GLY136C, GLY136D, HIS100C, HIS100D, HIS244C, HIS244D, HIS268C, HIS268D, ILE105C, ILE105D, LEU102C, LEU102D, LEU106C, LEU106D, LEU34C, LEU34D, PHE133C, PHE133D, SER131C, SER131D, SER264C, SER264D, THR247C, THR247D, THR286C, THR286D, TRP109C, TYR107C, TYR107D, VAL111C, VAL111D