3K9R

x-ray structure of the rhodanese-like domain of the alr3790 protein from anabaena sp. northeast structural genomics consortium target nsr437c.

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 104
  • Norm. En. per Res.: -4.0111
• 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	-54.7273	-61.8906	-300.537	-417.1549	104	12	5	11102	4	34	42
A-C	-12.9124	-3.595	-15.3461	-31.8534	14	1	0	490	0	5	6
A-D	-4.6705	-19.2456	-53.1647	-77.0807	38	1	2	2265	2	12	13
C-D	-84.0622	-22.8277	-278.272	-385.1618	103	12	4	10562	3	33	41

Interface residues

• A-B: ALA111B, ALA114B, ALA22A, ALA35A, ALA35B, ALA55A, ALA55B, ALA57A, ALA57B, ALA67A, ALA67B, ARG28A, ARG44A, ARG44B, ARG66A, ARG66B, ARG75A, ARG75B, ARG95B, ASN48A, ASN48B, ASP21A, ASP40A, ASP40B, ASP62A, ASP62B, ASP65A, ASP65B, ASP76A, ASP76B, GLU104B, GLU120A, GLU120B, GLU30B, GLU33A, GLU33B, GLU72A, GLU72B, GLY108B, GLY116A, GLY116B, GLY117B, GLY32B, GLY54A, GLY54B, HIS23A, HIS23B, HIS51A, HIS51B, ILE115B, ILE38A, ILE38B, ILE52A, ILE52B, ILE77B, LEU105B, LEU121A, LEU121B, LEU25A, LEU29A, LEU39A, LEU39B, LEU71A, LEU71B, LYS106B, LYS113B, LYS26A, LYS26B, LYS73A, LYS73B, PHE36A, PHE36B, PHE99A, PHE99B, PRO118A, PRO118B, PRO34A, PRO34B, PRO59A, PRO59B, SER103B, SER20A, SER27A, SER68A, SER68B, SER69A, SER69B, SER70A, SER70B, SER74A, SER74B, THR119B, THR37A, THR37B, TRP112B, TRP31B, TYR47A, TYR47B, TYR78B, TYR80B, VAL102B, VAL24A, VAL79B, VAL91B
• A-C: ARG44C, ASN48C, ASP43C, ASP49C, ASP84A, GLN86A, GLN89A, GLU85A, GLY83A, SER45C, SER88A, THR46C, THR87A, TYR47C
• A-D: ALA110A, ALA111A, ALA114A, ALA82A, ALA97D, ARG42A, ARG95D, ASN92D, ASP65D, ASP84A, GLU100D, GLU72D, GLU85A, GLY107A, GLY108A, GLY81A, GLY83A, GLY98D, HIS101D, ILE115A, LEU105A, LEU109A, LEU71D, LEU93D, LEU94D, LYS106A, LYS113A, LYS73D, PHE99D, SER68D, SER69D, SER74D, SER96D, THR87A, TRP112A, VAL102D, VAL64D, VAL91D
• C-D: ALA111C, ALA114C, ALA22D, ALA35C, ALA35D, ALA55C, ALA55D, ALA57C, ALA57D, ALA67C, ALA67D, ARG28D, ARG44C, ARG44D, ARG66C, ARG66D, ARG75C, ARG75D, ASN48C, ASN48D, ASP21D, ASP40C, ASP40D, ASP62C, ASP62D, ASP65C, ASP65D, ASP76C, ASP76D, GLU104C, GLU120C, GLU120D, GLU30C, GLU33C, GLU72C, GLU72D, GLY107C, GLY108C, GLY116C, GLY116D, GLY117C, GLY117D, GLY32C, GLY50D, GLY54C, GLY54D, HIS23D, HIS51C, HIS51D, ILE115C, ILE115D, ILE38C, ILE38D, ILE52C, ILE52D, ILE77C, LEU105C, LEU121C, LEU121D, LEU25D, LEU29D, LEU39C, LEU39D, LEU71C, LEU71D, LYS106C, LYS113C, LYS26C, LYS26D, LYS73C, LYS73D, PHE36C, PHE36D, PHE99C, PHE99D, PRO118C, PRO118D, PRO34C, PRO34D, PRO59C, PRO59D, SER103C, SER27D, SER68C, SER68D, SER69C, SER69D, SER70C, SER70D, SER74C, SER74D, THR119C, THR119D, THR37C, THR37D, TRP112C, TRP31C, TYR47C, TYR47D, TYR78C, TYR80C, VAL24D, VAL79C