file_model_pdb.cgito make a complex 3D model in PDB. coded by T.Kawabata. LastModified:2025/10/09 *Example for homo-multimer model. file_model_pdb.cgi pdb_id=[1gvj] asym1=[A] oper1=[1] asym2=[B] oper2=[1] sbjidA=[1gvj_A] *Example for hetero-multimer model. file_model_pdb.cgi pdb_id=[1gvj] asym1=[A] oper1=[1] asym2=[B] oper2=[1] sbjidA=[1gvj_A] sbjidB=[1gvj_B] *Example for protein-compound model. file_model_pdb.cgi pdb_id=[8igx] asym1=[A] oper1=[1] asym2=[B] oper2=[1] sbjidA=[8igx_A] sbjidB=[8igx_B PID : process_id [0] pdb_id : template PDB_ID. filename or id under the directory [] asym[n] : asym_id for subunit[n]. (n is 0,1,2,3,..) oper[n] : oper_expression for subunit[n]. (n is 0,1,2,3,..) que[n] : query type for subunit[n]. (n is 0,1,2,3,..) ('A':blast A, 'B': blast B, 'K':kcombu compound, 'N' or 'F':use it, just as it is) (NOTE: 'F' is mainly used for a protein detected by 'comp_sch'.) sbjidA : subject id for BLAST for query protein A []. sbjidB : subject id for BLAST for query protein B []. alignA : rank of alignment for modeling of query protein A (1,2,3,...) [1] alignB : rank of alignment for modeling of query protein B (1,2,3,...) [1] out : type of output. 'plain', 'html' or 'download'[plain] ofile : output file [] withmdl : with MODEL/ENDMDL line (T or F)[T] precalc_blt: Use precalculated BLAST for Uniprot for query proteins A and B[] chabc : re-naming chain ID as A,B,C,... (T or F) [F] q3dA : using 3D model for query A('T' or 'F')[F] q3dB : using 3D model for query B('T' or 'F')[F] QUNIPROT_AC_A: Query Uniprot AC for query protein A (only for 'precalc_blt=T')[] QUNIPROT_AC_B: Query Uniprot AC for query protein B (only for 'precalc_blt=T')[] QGENPEPT_ID_A: Query GenPept ID for query protein A (only for 'precalc_blt=T')[] QGENPEPT_ID_B: Query GenPept ID for query protein B (only for 'precalc_blt=T')[] QPDB_ID_A : Query PDB_ID for query protein A (only for 'q3dA=T') [] QASYM_ID_A : Query asym_id for query protein A (only for 'q3dA=T') [] QPDB_ID_B : Query PDB_ID for query protein B (only for 'q3dB=T') [] QASYM_ID_B : Query asym_id for query protein B (only for 'q3dB=T') [] QLIG_PDB3LETTER : PDB 3 letters for Query Ligand [] QLIG_KEGG_COMPOUND_DRUG_ID: KEGG_COMPOUND_ID (C*****) or KEGG_DRUG_ID (D*****)[] -con : Connectivity.'D'isconnected,'C'onnected, 'S'ubstructure(A<=B), 'I'somorphic (A=B), : 'T'opo_constrained_disconnected 't'opo_constrained_connected)[T] -mtd : max difference of topological distance(num of bonds in the shortest path).<0:don't care. [1]