6TZ8
Crystal structure of Cryptococcus neoformans Calceineurin A, Calcineurin B, and FKBP12 with FK-506
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, D (A, D) | Serine/threonine-protein phosphatase 2B catalytic subunit A1 | polymer | 390 | 45253.3 | 2 | UniProt (O42773) | Cryptococcus neoformans var. grubii serotype A (strain H99 / ATCC 208821 / CBS 10515 / FGSC 9487) | Calcineurin A1 |
| 2 | B, E (B, E) | Calcineurin subunit B | polymer | 175 | 19700.3 | 2 | UniProt (J9VL81) | Cryptococcus neoformans var. grubii serotype A (strain H99 / ATCC 208821 / CBS 10515 / FGSC 9487) | |
| 3 | C, F (C, F) | FK506-binding protein 1 | polymer | 122 | 13333.1 | 2 | UniProt (O94746) | Cryptococcus neoformans var. grubii serotype A (strain H99 / ATCC 208821 / CBS 10515 / FGSC 9487) | FKBP,Peptidyl-prolyl cis-trans isomerase,PPIase,Rapamycin-binding protein |
| 4 | G, J, P (A, D) | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
| 5 | H, Q (A, D) | FE (III) ION | non-polymer | 55.8 | 2 | Chemie (FE) PubChem (29936) | |||
| 6 | I, R (A, D) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 7 | K, L, M, N, S... (B, E) | CALCIUM ION | non-polymer | 40.1 | 8 | Chemie (CA) PubChem (271) | |||
| 8 | O, W (C, F) | 8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN | non-polymer | 804.0 | 2 | Chemie (FK5) PubChem (23377000) PubChem (177746942) PubChem (23308325) PubChem (23581796) PubChem (24978521) PubChem (54611630) PubChem (57206900) PubChem (44294761) PubChem (44314852) PubChem (403209) PubChem (439492) PubChem (59042420) PubChem (59111253) PubChem (59112447) PubChem (59118415) PubChem (44575549) PubChem (59746606) PubChem (46783859) PubChem (59917266) PubChem (59918741) PubChem (60086106) PubChem (46781577) PubChem (66509027) PubChem (66672804) PubChem (49874294) PubChem (71296869) PubChem (71316759) PubChem (71668407) PubChem (73265325) PubChem (57417278) PubChem (57892354) PubChem (57910335) PubChem (58584114) PubChem (59032416) PubChem (58946030) PubChem (59141120) PubChem (59049316) PubChem (59974193) PubChem (59993548) PubChem (60035606) PubChem (66709866) PubChem (67340654) PubChem (67626881) PubChem (68219140) PubChem (68712665) PubChem (69247758) PubChem (176478128) PubChem (89068341) PubChem (176856280) PubChem (177675132) PubChem (5372) PubChem (64779) PubChem (445643) PubChem (77906388) PubChem (89249909) PubChem (89545901) PubChem (89960652) PubChem (5353987) PubChem (145857191) PubChem (117646237) PubChem (6426916) PubChem (6436007) PubChem (6473866) PubChem (123552884) PubChem (5472317) PubChem (9832283) PubChem (9853905) PubChem (125039862) PubChem (9918805) PubChem (125136698) PubChem (125136697) PubChem (9963169) PubChem (129009965) PubChem (129010422) PubChem (130330191) PubChem (131676819) PubChem (6536850) PubChem (6610362) PubChem (6912836) PubChem (133562888) PubChem (133688365) PubChem (11556866) PubChem (134694629) PubChem (9940643) PubChem (12134936) PubChem (13006299) PubChem (137705868) PubChem (138106951) PubChem (138574020) PubChem (124511204) PubChem (140494820) PubChem (13819070) PubChem (140647114) PubChem (13819074) PubChem (13819069) PubChem (140893615) PubChem (13819073) PubChem (149048732) PubChem (125039860) PubChem (125039861) PubChem (125136699) PubChem (125136700) PubChem (160433486) PubChem (162711219) PubChem (163027397) PubChem (163027399) PubChem (163027400) PubChem (125182986) PubChem (126687738) PubChem (166023667) PubChem (168312998) PubChem (170277719) PubChem (171042252) PubChem (171360199) PubChem (172042935) PubChem (173882479) PubChem (129606865) PubChem (131668141) PubChem (137546410) PubChem (137546581) PubChem (138574025) PubChem (139032034) PubChem (140652196) PubChem (143265740) PubChem (144640477) PubChem (146323807) PubChem (156417380) PubChem (156528350) PubChem (160433487) PubChem (163027398) PubChem (163027401) PubChem (163027402) PubChem (167413568) PubChem (170997009) PubChem (171122179) PubChem (171137683) PubChem (171156312) PubChem (171322980) PubChem (171329370) PubChem (172634670) PubChem (175667550) | |||
| 9 | AA, X, Y, Z (E, A, B, D) | water | water | 18.0 | 9 | Chemie (HOH) |
Sequence modifications
A, D: 34 - 402 (UniProt: O42773)
C, F: 2 - 108 (UniProt: O94746)
| PDB | External Database | Details |
|---|---|---|
| Met 13 | - | expression tag |
| Gly 14 | - | expression tag |
| Ser 15 | - | expression tag |
| Ser 16 | - | expression tag |
| His 17 | - | expression tag |
| His 18 | - | expression tag |
| His 19 | - | expression tag |
| His 20 | - | expression tag |
| His 21 | - | expression tag |
| His 22 | - | expression tag |
| Ser 23 | - | expression tag |
| Ser 24 | - | expression tag |
| Gly 25 | - | expression tag |
| Glu 26 | - | expression tag |
| Asn 27 | - | expression tag |
| Leu 28 | - | expression tag |
| Tyr 29 | - | expression tag |
| Phe 30 | - | expression tag |
| Gln 31 | - | expression tag |
| Gly 32 | - | expression tag |
| Ser 33 | - | expression tag |
| PDB | External Database | Details |
|---|---|---|
| Met -9 | - | expression tag |
| Trp -8 | - | expression tag |
| Ser -7 | - | expression tag |
| His -6 | - | expression tag |
| Pro -5 | - | expression tag |
| Gln -4 | - | expression tag |
| Phe -3 | - | expression tag |
| Glu -2 | - | expression tag |
| Lys -1 | - | expression tag |
| Gly 0 | - | expression tag |
| Ser 1 | - | expression tag |
| Lys 9 | Ser 9 | engineered mutation |
| Glu 10 | Ala 10 | conflict |
| Asn 12 | Asp 12 | conflict |
| Val 14 | Lys 14 | engineered mutation |
| Asp 15 | Thr 15 | conflict |
| Lys 16 | Phe 16 | conflict |
| Val 18 | Gln 18 | conflict |
| Lys 19 | Pro 19 | conflict |
| Leu 69 | Val 69 | conflict |
| Glu 71 | Gln 71 | conflict |
| Ser 109 | - | expression tag |
| Lys 110 | - | expression tag |
| Arg 111 | - | expression tag |
| Ala 112 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 6 |
| Total formula weight | 156573.3 | |
| Non-Polymers* | Number of molecules | 17 |
| Total formula weight | 2459.4 | |
| All* | Total formula weight | 159032.6 |
